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rac-S-2-[N-(2-Hydroxy-1,1-dimethylethyl)aminocarbonylthio]-2-phenyloctane
SpectraBase Compound ID DJrkQVdkAuA
InChI InChI=1S/C19H31NO2S/c1-5-6-7-11-14-19(4,16-12-9-8-10-13-16)23-17(22)20-18(2,3)15-21/h8-10,12-13,21H,5-7,11,14-15H2,1-4H3,(H,20,22)/t19-/m0/s1
InChIKey WSBOZSRNGISNBM-IBGZPJMESA-N
Mol Weight 337.52 g/mol
Molecular Formula C19H31NO2S
Exact Mass 337.20755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWhjqg5cXKh
Name rac-S-2-[N-(2-Hydroxy-1,1-dimethylethyl)aminocarbonylthio]-2-phenyloctane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31NO2S
InChI InChI=1S/C19H31NO2S/c1-5-6-7-11-14-19(4,16-12-9-8-10-13-16)23-17(22)20-18(2,3)15-21/h8-10,12-13,21H,5-7,11,14-15H2,1-4H3,(H,20,22)/t19-/m0/s1
InChIKey WSBOZSRNGISNBM-IBGZPJMESA-N
Molecular Weight 337.522 g/mol
SMILES N(C(S[C@](c1ccccc1)(CCCCCC)C)=O)C(CO)(C)C
SPLASH splash10-0a4l-4900000000-68cc19292e52801583d5
Source of Spectrum QE-7-433-12
Synonyms S-[(1S)-1-methyl-1-phenylheptyl]2-hydroxy-1,1-dimethylethylthiocarbamate
Wiley ID 1557013