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Trans-N-[(S)-1-phenylethyl]-2-benzylsulfanycyclohexylamine

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Trans-N-[(S)-1-phenylethyl]-2-benzylsulfanycyclohexylamine
SpectraBase Compound ID 558lSz4VGwR
InChI InChI=1S/C21H27NS/c1-17(19-12-6-3-7-13-19)23-21-15-9-8-14-20(21)22-16-18-10-4-2-5-11-18/h2-7,10-13,17,20-22H,8-9,14-16H2,1H3/t17-,20-,21-/m1/s1
InChIKey MSXBAUQKPRQEFI-DUXKGJEZSA-N
Mol Weight 325.51 g/mol
Molecular Formula C21H27NS
Exact Mass 325.186421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L59LucZNSO9
Name trans-N-[(S)-1-Phenylethyl]-2-benzylsulfanycyclohexylamine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NS
InChI InChI=1S/C21H27NS/c1-17(19-12-6-3-7-13-19)23-21-15-9-8-14-20(21)22-16-18-10-4-2-5-11-18/h2-7,10-13,17,20-22H,8-9,14-16H2,1H3/t17-,20-,21-/m1/s1
InChIKey MSXBAUQKPRQEFI-DUXKGJEZSA-N
Molecular Weight 325.514 g/mol
SMILES N([C@]1([C@](S[C@@](c2ccccc2)(C)[H])(CCCC1)[H])[H])Cc1ccccc1
SPLASH splash10-0a4l-4941000000-7bb238459763f4d524dc
Source of Spectrum KC-1-364-19
Wiley ID 1577575