1-Propene, 3-[(1-methylethyl)thio]-

SpectraBase Compound ID	DKjOvGRFLEX
InChI	InChI=1S/C6H12S/c1-4-5-7-6(2)3/h4,6H,1,5H2,2-3H3
InChIKey	OJBPXSILEFOOQD-UHFFFAOYSA-N Google Search
Mol Weight	116.22 g/mol
Molecular Formula	C6H12S
Exact Mass	116.065972 g/mol

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SpectraBase Spectrum ID	67hu3IUtF0d
Name	Allyl isopropyl sulfide
CAS Registry Number	33922-70-2
Copyright	Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass	116.065971560 u
Formula	C6H12S
InChI	InChI=1S/C6H12S/c1-4-5-7-6(2)3/h4,6H,1,5H2,2-3H3
InChIKey	OJBPXSILEFOOQD-UHFFFAOYSA-N
Molecular Weight	116.222 g/mol
Number of Peaks	50
RI1	870
RI2	533
SMILES	C=CCSC(C)C
SPLASH	splash10-00dm-9100000000-e77e3012e5a5abcac071
Sample Comments	RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum	Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms	1-Propene, 3-[(1-methylethyl)thio]-
Wiley ID	LM_FFNSC3_1858