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(Z)-6-Ethyl-5-(phenylthio)-5-tridecene-7-yne
SpectraBase Compound ID 9saRdokeRQK
InChI InChI=1S/C21H30S/c1-4-7-9-10-12-15-19(6-3)21(18-8-5-2)22-20-16-13-11-14-17-20/h11,13-14,16-17H,4-10,18H2,1-3H3/b21-19-
InChIKey RRPZDRMCKUSFAU-VZCXRCSSSA-N
Mol Weight 314.53 g/mol
Molecular Formula C21H30S
Exact Mass 314.206822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dmmPWV3sph
Name (Z)-6-Ethyl-5-(phenylthio)-5-tridecene-7-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30S
InChI InChI=1S/C21H30S/c1-4-7-9-10-12-15-19(6-3)21(18-8-5-2)22-20-16-13-11-14-17-20/h11,13-14,16-17H,4-10,18H2,1-3H3/b21-19-
InChIKey RRPZDRMCKUSFAU-VZCXRCSSSA-N
Molecular Weight 314.531 g/mol
SMILES CCCC\C(=C\(C#CCCCCC)CC)Sc1ccccc1
SPLASH splash10-001i-3942000000-7ccaaad5b79694b38c86
Source of Spectrum KC-60-377-3
Synonyms (1Z)-1-butyl-2-ethyl-1-nonen-3-ynyl phenyl sulfide {[(1Z)-1-butyl-2-ethyl-1-nonen-3-ynyl]sulfanyl}benzene
Wiley ID 1582951