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(Trans)-4-tert-butyl-2-(naphthalen-2-ylsulfanyl)-cyclohexanone
SpectraBase Compound ID LegHHuEzfNV
InChI InChI=1S/C20H24OS/c1-20(2,3)16-9-11-18(21)19(13-16)22-17-10-8-14-6-4-5-7-15(14)12-17/h4-8,10,12,16,19H,9,11,13H2,1-3H3/t16-,19+/m0/s1
InChIKey WSGNMNRHNLHZPT-QFBILLFUSA-N
Mol Weight 312.47 g/mol
Molecular Formula C20H24OS
Exact Mass 312.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7bTKTIlDkdC
Name (trans)-4-tert-Butyl-2-(naphthalen-2-ylsulfanyl)-cyclohexanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24OS
InChI InChI=1S/C20H24OS/c1-20(2,3)16-9-11-18(21)19(13-16)22-17-10-8-14-6-4-5-7-15(14)12-17/h4-8,10,12,16,19H,9,11,13H2,1-3H3/t16-,19+/m0/s1
InChIKey WSGNMNRHNLHZPT-QFBILLFUSA-N
Molecular Weight 312.471 g/mol
SMILES C1C([C@@](C[C@](C1)(C(C)(C)C)[H])(Sc1cc2c(cc1)cccc2)[H])=O
SPLASH splash10-03di-0129000000-1c228383fd6d166e04a2
Source of Spectrum RSA-5-96702-7i_major
Synonyms (2R,4S)-4-(tert-butyl)-2-(naphthalen-2-ylthio)cyclohexan-1-one
Wiley ID 1802729