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(3E,4S,5S)-3-hexadecylidene-4-hydroxy-5-methyl-2-oxolanone
SpectraBase Compound ID DBcFTPotI3k
InChI InChI=1S/C21H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h17-18,20,22H,3-16H2,1-2H3/b19-17+/t18-,20+/m0/s1
InChIKey LAJHPFCGLXGQIB-PZTJZYIESA-N
Mol Weight 338.5 g/mol
Molecular Formula C21H38O3
Exact Mass 338.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZBmBtUvT2c
Name (3E,4S,5S)-3-hexadecylidene-4-hydroxy-5-methyl-2-oxolanone
CAS Registry Number 71358-20-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38O3
InChI InChI=1S/C21H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h17-18,20,22H,3-16H2,1-2H3/b19-17+/t18-,20+/m0/s1
InChIKey LAJHPFCGLXGQIB-PZTJZYIESA-N
Molecular Weight 338.532 g/mol
SMILES O[C@]1(\C(C(O[C@]1(C)[H])=O)=C/CCCCCCCCCCCCCCC)[H]
SPLASH splash10-0006-9000000000-fd80b72324053115519e
Source of Spectrum W5-1989-12344-1
Synonyms (3E,4S,5S)-3-hexadecylidene-4-hydroxy-5-methyl-tetrahydrofuran-2-one (3E,4S,5S)-3-hexadecylidene-4-hydroxy-5-methyloxolan-2-one (3E,4S,5S)-3-hexadecylidene-5-methyl-4-oxidanyl-oxolan-2-one
Wiley ID 1334094