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Valeric acid, 3,5-dihydroxy-2,4-dimethyl-, .delta.-lactone
SpectraBase Compound ID JV6bGMWCnng
InChI InChI=1S/C7H12O3/c1-4-3-10-7(9)5(2)6(4)8/h4-6,8H,3H2,1-2H3
InChIKey SQNHDUPQGWTYSL-UHFFFAOYSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fg0bOxgAKj0
Name Valeric acid, 3,5-dihydroxy-2,4-dimethyl-, .delta.-lactone
CAS Registry Number 109717-37-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-4-3-10-7(9)5(2)6(4)8/h4-6,8H,3H2,1-2H3
InChIKey SQNHDUPQGWTYSL-UHFFFAOYSA-N
Molecular Weight 144.170 g/mol
SMILES OC1C(C(OCC1C)=O)C
SPLASH splash10-0ab9-9000000000-f45e02249e2ba92e6986
Synonyms 3,5-Dimethyl-4-oxidanyl-oxan-2-one 4-Hydroxy-3,5-dimethyl-2-oxanone 4-Hydroxy-3,5-dimethyl-tetrahydropyran-2-one 4-Hydroxy-3,5-dimethyloxan-2-one
Wiley ID 1486979