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(Z)-3-[1'-(phenylthio)oct-2'-enyl]butan-4-olide
SpectraBase Compound ID B8Q2JmdAJb5
InChI InChI=1S/C18H24O2S/c1-2-3-4-5-9-12-17(15-13-18(19)20-14-15)21-16-10-7-6-8-11-16/h6-12,15,17H,2-5,13-14H2,1H3/b12-9-
InChIKey MHQGRBCWKXXKQX-XFXZXTDPSA-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 3WR8jjFrqa0
Name (Z)-3-[1'-(phenylthio)oct-2'-enyl]butan-4-olide
CAS Registry Number 113460-81-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O2S
InChI InChI=1S/C18H24O2S/c1-2-3-4-5-9-12-17(15-13-18(19)20-14-15)21-16-10-7-6-8-11-16/h6-12,15,17H,2-5,13-14H2,1H3/b12-9-
InChIKey MHQGRBCWKXXKQX-XFXZXTDPSA-N
Molecular Weight 304.448 g/mol
SMILES C1(OCC(C1)C(Sc1ccccc1)\C=C/CCCCC)=O
SPLASH splash10-05ot-5920000000-78a4090ca082b4a179c5
Source of Spectrum B-40-1242-22
Synonyms 4-[(2Z)-1-(phenylsulfanyl)-2-octenyl]dihydro-2(3H)-furanone
Wiley ID 1306548