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6-(1-Hydroxy-cyclohexyl)-2-P-tolylsulfinyl-cyclohexanone
SpectraBase Compound ID 9luaX12wNMK
InChI InChI=1S/C19H26O3S/c1-14-8-10-15(11-9-14)23(22)17-7-5-6-16(18(17)20)19(21)12-3-2-4-13-19/h8-11,16-17,21H,2-7,12-13H2,1H3
InChIKey SWIJGCXWBDTLLX-UHFFFAOYSA-N
Mol Weight 334.47 g/mol
Molecular Formula C19H26O3S
Exact Mass 334.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67ZJqILKOus
Name [1,1'-Bicyclohexyl]-2-one, 1'-hydroxy-3-[(4-methylphenyl)sulfinyl]-
CAS Registry Number 124770-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3S
InChI InChI=1S/C19H26O3S/c1-14-8-10-15(11-9-14)23(22)17-7-5-6-16(18(17)20)19(21)12-3-2-4-13-19/h8-11,16-17,21H,2-7,12-13H2,1H3
InChIKey SWIJGCXWBDTLLX-UHFFFAOYSA-N
Molecular Weight 334.474 g/mol
SMILES OC1(C2C(C(S(c3ccc(cc3)C)=O)CCC2)=O)CCCCC1
SPLASH splash10-05mn-9500000000-0b8cc106ff4221d79cfd
Source of Spectrum KC-1989-1337-8
Synonyms 2-(1-hydroxycyclohexyl)-6-[(4-methylbenzene)sulfinyl]cyclohexan-1-one 6-(1-Hydroxycyclohexyl)-2-p-tolylsulphinylcyclohexanone
Wiley ID 1330958