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(1R,2R)-1-[N-Methyl-N-(4-phenylthio)phenyl]amino-2-(phenylthio)cyclohexane
SpectraBase Compound ID D5L3i7WuNhP
InChI InChI=1S/C25H27NS2/c1-26(20-16-18-23(19-17-20)27-21-10-4-2-5-11-21)24-14-8-9-15-25(24)28-22-12-6-3-7-13-22/h2-7,10-13,16-19,24-25H,8-9,14-15H2,1H3/t24-,25-/m1/s1
InChIKey XYCIOABBLWTFLA-JWQCQUIFSA-N
Mol Weight 405.62 g/mol
Molecular Formula C25H27NS2
Exact Mass 405.158492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fub2N1KvTrI
Name (1R,2R)-1-[N-Methyl-N-(4-phenylthio)phenyl]amino-2-(phenylthio)cyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NS2
InChI InChI=1S/C25H27NS2/c1-26(20-16-18-23(19-17-20)27-21-10-4-2-5-11-21)24-14-8-9-15-25(24)28-22-12-6-3-7-13-22/h2-7,10-13,16-19,24-25H,8-9,14-15H2,1H3/t24-,25-/m1/s1
InChIKey XYCIOABBLWTFLA-JWQCQUIFSA-N
Molecular Weight 405.618 g/mol
SMILES [C@@]1(N(c2ccc(Sc3ccccc3)cc2)C)([C@](Sc2ccccc2)(CCCC1)[H])[H]
SPLASH splash10-0a4i-0250900000-1bce6f7b2787853da878
Source of Spectrum F-49-9103-13
Synonyms N-methyl-4-(phenylsulfanyl)-N-[(1R,2R)-2-(phenylsulfanyl)cyclohexyl]aniline N-methyl-N-[(1R,2R)-2-(phenylsulfanyl)cyclohexyl]-N-[4-(phenylsulfanyl)phenyl]amine trans-1-[N-Methyl-N-(4-phenylthio)phenyl]amino-2-(phenylthio)cyclohexane
Wiley ID 788478