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General information

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Reference substance information

IUPAC name:
2-[(naphthalen-1-yl)methyl]-2-[(oxolan-2-yl)methyl]propanedioic acid hydrate
Synonyms
Names:
(1-naphthylmethyl)(tetrahydrofuran-2-ylmethyl)malonic acid hydrate (1:1)

Molecular and structural information

Molecular formula:
C19H20O5.H2O
Molecular weight:
346
SMILES notation:
O.O=C(O)C(Cc1cccc2ccccc12)(CC3CCCO3)C(=O)O
InChl:
InChI=1/C19H20O5.H2O/c20-17(21)19(18(22)23,12-15-8-4-10-24-15)11-14-7-3-6-13-5-1-2-9-16(13)14;/h1-3,5-7,9,15H,4,8,10-12H2,(H,20,21)(H,22,23);1H2
Structural formula:
Chemical structure