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(E)-3-[3'-(phenylthio)-1'-pentylprop-2'-enyl]butan-4-olide
SpectraBase Compound ID GCslZTYDgQs
InChI InChI=1S/C18H24O2S/c1-2-3-5-8-15(16-13-18(19)20-14-16)11-12-21-17-9-6-4-7-10-17/h4,6-7,9-12,15-16H,2-3,5,8,13-14H2,1H3/b12-11+
InChIKey WCNMCLNLIFZKKG-VAWYXSNFSA-N
Mol Weight 304.45 g/mol
Molecular Formula C18H24O2S
Exact Mass 304.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hxIgUeILQs
Name (E)-3-[3'-(phenylthio)-1'-pentylprop-2'-enyl]butan-4-olide
Alternate Name(s) 4-[(2E)-1-pentyl-3-(phenylsulfanyl)-2-propenyl]dihydro-2(3H)-furanone
CAS Registry Number 113460-77-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O2S
InChI InChI=1S/C18H24O2S/c1-2-3-5-8-15(16-13-18(19)20-14-16)11-12-21-17-9-6-4-7-10-17/h4,6-7,9-12,15-16H,2-3,5,8,13-14H2,1H3/b12-11+
InChIKey WCNMCLNLIFZKKG-VAWYXSNFSA-N
Molecular Weight 304.448 g/mol
SMILES C1(OCC(C1)C(\C=C\Sc1ccccc1)CCCCC)=O
SPLASH splash10-016r-9574000000-923b09f890ae6ce279be
Source of Spectrum B-40-1241-18
Wiley ID 1306546