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Identification

Display Name:
Essential oil of Petitgrain obtained from the leaves and twigs of Citrus aurantium (Rutaceae) by distillation
EC Number:
946-433-7
CAS Number:
Not available
Molecular formula:
Not applicable for a natural complex substance (UVCB)
IUPAC Name:
Essential oil of Petitgrain obtained from the leaves and twigs of Citrus aurantium (Rutaceae) by distillation

Type of Substance

Composition:
UVCB
Origin:
other: NCS (Natural Complex Substance)

Substance Identifiers open all close all

  • 277-143-2
  • 277-143-2
  • 277-143-2
  • 946-433-7
  • 72968-50-4
  • 72968-50-4
  • 72968-50-4
  • 8014-17-3
  • 8014-17-3
  • Essential oil of Petitgrain obtained from the leaves and twigs of Citrus aurantium (Rutaceae) by distiliation
  • PETITGRAIN OIL
  • PETITGRAIN PARAGUAY EO ; PETITGRAIN PARAGUAY OIL
  • Petitgrain Oil, Petitgrain Oil (Paraguay), Petitgrain Oil (Bigarade), Petitgrain Oil (Terpeneless)
  • Petitgrain Paraguay oil
  • Compositions

    Boundary Composition(s) open all close all

    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Linalyl acetate
    EC Number:
    204-116-4
    EC Name:
    Linalyl acetate
    CAS Number:
    115-95-7
    Molecular formula:
    C12H20O2
    IUPAC Name:
    3,7-dimethylocta-1,6-dien-3-yl acetate
    Constituent 2
    Chemical structure
    Reference substance name:
    Linalool
    EC Number:
    201-134-4
    EC Name:
    Linalool
    CAS Number:
    78-70-6
    Molecular formula:
    C10H18O
    IUPAC Name:
    3,7-Dimethylocta-1,6-dien-3-ol
    Constituent 3
    Chemical structure
    Reference substance name:
    Geraniol
    EC Number:
    203-377-1
    EC Name:
    Geraniol
    CAS Number:
    106-24-1
    Molecular formula:
    C10H18O
    IUPAC Name:
    (2E)-3,7-dimethylocta-2,6-dien-1-ol
    Constituent 4
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-ol
    EC Number:
    202-680-6
    EC Name:
    p-menth-1-en-8-ol
    CAS Number:
    98-55-5
    Molecular formula:
    C10H18O
    IUPAC Name:
    2-(4-methyl-1-cyclohex-3-enyl)propan-2-ol
    Constituent 5
    Chemical structure
    Reference substance name:
    Geranyl acetate
    EC Number:
    203-341-5
    EC Name:
    Geranyl acetate
    CAS Number:
    105-87-3
    Molecular formula:
    C12H20O2
    IUPAC Name:
    3,7-dimethylocta-2,6-dien-1-yl acetate
    Constituent 6
    Chemical structure
    Reference substance name:
    (±)-1-methyl-4-(1-methylvinyl)cyclohexene
    EC Number:
    231-732-0
    EC Name:
    (±)-1-methyl-4-(1-methylvinyl)cyclohexene
    CAS Number:
    7705-14-8
    Molecular formula:
    C10H16
    IUPAC Name:
    1-methyl-4-(methylvinyl)cyclohex-1-ene
    Constituent 7
    Chemical structure
    Reference substance name:
    7-methyl-3-methyleneocta-1,6-diene
    EC Number:
    204-622-5
    EC Name:
    7-methyl-3-methyleneocta-1,6-diene
    CAS Number:
    123-35-3
    Molecular formula:
    C10H16
    IUPAC Name:
    7-Methyl-3-methylene-1,6-octadiene
    Constituent 8
    Chemical structure
    Reference substance name:
    Citral
    EC Number:
    226-394-6
    EC Name:
    Citral
    CAS Number:
    5392-40-5
    Molecular formula:
    C10H16O
    IUPAC Name:
    3,7-dimethylocta-2,6-dienal
    Constituent 9
    Chemical structure
    Reference substance name:
    (Z)-3,7-dimethylocta-1,3,6,-triene
    EC Number:
    222-081-3
    EC Name:
    (Z)-3,7-dimethylocta-1,3,6,-triene
    CAS Number:
    3338-55-4
    Molecular formula:
    C10H16
    IUPAC Name:
    (Z)-3,7-dimethylocta-1,3,6,-triene
    Constituent 10
    Chemical structure
    Reference substance name:
    Nerol
    EC Number:
    203-378-7
    EC Name:
    Nerol
    CAS Number:
    106-25-2
    Molecular formula:
    C10H18O
    IUPAC Name:
    (2Z)-3,7-dimethylocta-2,6-dien-1-ol
    Constituent 11
    Chemical structure
    Reference substance name:
    Neryl acetate
    EC Number:
    205-459-2
    EC Name:
    Neryl acetate
    CAS Number:
    141-12-8
    Molecular formula:
    C12H20O2
    IUPAC Name:
    [(2Z)-3,7-dimethylocta-2,6-dienyl] acetate
    Constituent 12
    Chemical structure
    Reference substance name:
    Pin-2(10)-ene
    EC Number:
    204-872-5
    EC Name:
    Pin-2(10)-ene
    CAS Number:
    127-91-3
    Molecular formula:
    C10H16
    IUPAC Name:
    6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptane
    Constituent 13
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-yl acetate
    EC Number:
    201-265-7
    EC Name:
    p-menth-1-en-8-yl acetate
    CAS Number:
    80-26-2
    Molecular formula:
    C12H20O2
    IUPAC Name:
    2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl acetate
    Constituent 14
    Chemical structure
    Reference substance name:
    Caryophyllene
    EC Number:
    201-746-1
    EC Name:
    Caryophyllene
    CAS Number:
    87-44-5
    Molecular formula:
    C15H24
    IUPAC Name:
    [1R-(1R*,4E,9S*)]-4,11,11-trimethyl-8-methylene-Bicyclo[7.2.0]undec-4-ene
    Constituent 15
    Chemical structure
    Reference substance name:
    Pin-2(3)-ene
    EC Number:
    201-291-9
    EC Name:
    Pin-2(3)-ene
    CAS Number:
    80-56-8
    Molecular formula:
    C10H16
    IUPAC Name:
    4,6,6-trimethylbicyclo[3.1.1]hept-3-ene
    Constituent 16
    Chemical structure
    Reference substance name:
    Thuj-4(10)-ene
    EC Number:
    222-212-4
    EC Name:
    Thuj-4(10)-ene
    CAS Number:
    3387-41-5
    Molecular formula:
    C10H16
    IUPAC Name:
    Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)
    Constituent 17
    Chemical structure
    Reference substance name:
    p-mentha-1,4(8)-diene
    EC Number:
    209-578-0
    EC Name:
    p-mentha-1,4(8)-diene
    CAS Number:
    586-62-9
    Molecular formula:
    C10H16
    IUPAC Name:
    4-isopropylidene-1-methylcyclohexene
    Constituent 18
    Chemical structure
    Reference substance name:
    p-cymene
    EC Number:
    202-796-7
    EC Name:
    p-cymene
    CAS Number:
    99-87-6
    Molecular formula:
    C10H14
    IUPAC Name:
    1-methyl-4-propan-2-ylbenzene
    Constituent 19
    Reference substance name:
    Unknown and other minor constituents of Essential oil of Petitgrain obtained from the leaves and twigs of Citrus aurantium (Rutaceae) by distillation
    IUPAC Name:
    Unknown and other minor constituents of Essential oil of Petitgrain obtained from the leaves and twigs of Citrus aurantium (Rutaceae) by distillation
    State Form:
    liquid


    Constituent 1
    Chemical structure
    Reference substance name:
    Linalyl acetate
    EC Number:
    204-116-4
    EC Name:
    Linalyl acetate
    CAS Number:
    115-95-7
    Molecular formula:
    C12H20O2
    IUPAC Name:
    3,7-dimethylocta-1,6-dien-3-yl acetate
    Constituent 2
    Chemical structure
    Reference substance name:
    Linalool
    EC Number:
    201-134-4
    EC Name:
    Linalool
    CAS Number:
    78-70-6
    Molecular formula:
    C10H18O
    IUPAC Name:
    3,7-Dimethylocta-1,6-dien-3-ol
    Constituent 3
    Chemical structure
    Reference substance name:
    p-menth-1-en-8-ol
    EC Number:
    202-680-6
    EC Name:
    p-menth-1-en-8-ol
    CAS Number:
    98-55-5
    Molecular formula:
    C10H18O
    IUPAC Name:
    2-(4-methyl-1-cyclohex-3-enyl)propan-2-ol