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2-Allyl-2-(phenylthio)-1-(1-cyclohexenyl)cyclobutanol
SpectraBase Compound ID Cdk9aeriBvS
InChI InChI=1S/C19H24OS/c1-2-13-18(21-17-11-7-4-8-12-17)14-15-19(18,20)16-9-5-3-6-10-16/h2,4,7-9,11-12,20H,1,3,5-6,10,13-15H2
InChIKey DSAUJBOPWMYBCS-UHFFFAOYSA-N
Mol Weight 300.46 g/mol
Molecular Formula C19H24OS
Exact Mass 300.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Amr0ilreS0u
Name 2-Allyl-2-(phenylthio)-1-(1-cyclohexenyl)cyclobutanol
Alternate Name(s) 2-allyl-1-(1-cyclohexen-1-yl)-2-(phenylsulfanyl)cyclobutanol
CAS Registry Number 98678-11-6
Comments Less than 3 mono-isotopic peaks
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Formula C19H24OS
InChI InChI=1S/C19H24OS/c1-2-13-18(21-17-11-7-4-8-12-17)14-15-19(18,20)16-9-5-3-6-10-16/h2,4,7-9,11-12,20H,1,3,5-6,10,13-15H2
InChIKey DSAUJBOPWMYBCS-UHFFFAOYSA-N
Molecular Weight 300.460 g/mol
SMILES OC1(C(Sc2ccccc2)(CC=C)CC1)C1=CCCCC1
SPLASH splash10-0006-0900000000-8211d5ad9c70e0feb1d8
Source of Spectrum J-50-4599-10
Wiley ID 1303192