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2,4,4-trimethyl-3-(phenylsulfanylmethyl)cyclohex-2-en-1-ol
SpectraBase Compound ID KQrjIHIr2dm
InChI InChI=1S/C16H22OS/c1-12-14(16(2,3)10-9-15(12)17)11-18-13-7-5-4-6-8-13/h4-8,15,17H,9-11H2,1-3H3
InChIKey CIYDULBPFRYITI-UHFFFAOYSA-N
Mol Weight 262.41 g/mol
Molecular Formula C16H22OS
Exact Mass 262.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3VaPsIGPU7U
Name 2,4,4-trimethyl-3-(phenylsulfanylmethyl)cyclohex-2-en-1-ol
Comments Less than 3 mono-isotopic peaks
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Formula C16H22OS
InChI InChI=1S/C16H22OS/c1-12-14(16(2,3)10-9-15(12)17)11-18-13-7-5-4-6-8-13/h4-8,15,17H,9-11H2,1-3H3
InChIKey CIYDULBPFRYITI-UHFFFAOYSA-N
Molecular Weight 262.411 g/mol
SMILES OC1C(=C(C(CC1)(C)C)CSc1ccccc1)C
SPLASH splash10-03di-0930000000-e132bdfa162b12fe6b7f
Source of Spectrum F-56-3931-13
Synonyms 2,4,4-trimethyl-3-[(phenylthio)methyl]-1-cyclohex-2-enol
Wiley ID 857124