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[(R)-1-((S)-1-Mercapto-2-phenyl-ethyl)-pentyl]-carbamic acid methyl ester
SpectraBase Compound ID ClbmW6P8pYW
InChI InChI=1S/C15H23NO2S/c1-3-4-10-13(16-15(17)18-2)14(19)11-12-8-6-5-7-9-12/h5-9,13-14,19H,3-4,10-11H2,1-2H3,(H,16,17)/t13-,14+/m1/s1
InChIKey TXIBZINDGZWSLI-KGLIPLIRSA-N
Mol Weight 281.41 g/mol
Molecular Formula C15H23NO2S
Exact Mass 281.14495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7npvSf994Pm
Name [(R)-1-((S)-1-Mercapto-2-phenyl-ethyl)-pentyl]-carbamic acid methyl ester
Alternate Name(s) (S,R)-[1-(1-Mercapto-2-phenylethyl)pentyl]carbamic acid methyl ester Methyl (1R)-1-[(1S)-2-phenyl-1-sulfanylethyl]pentylcarbamate
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Formula C15H23NO2S
InChI InChI=1S/C15H23NO2S/c1-3-4-10-13(16-15(17)18-2)14(19)11-12-8-6-5-7-9-12/h5-9,13-14,19H,3-4,10-11H2,1-2H3,(H,16,17)/t13-,14+/m1/s1
InChIKey TXIBZINDGZWSLI-KGLIPLIRSA-N
Molecular Weight 281.414 g/mol
SMILES N(C(=O)OC)[C@@]([C@](Cc1ccccc1)(S)[H])(CCCC)[H]
SPLASH splash10-0006-3900000000-551edc9f1ea7c00c5d92
Source of Spectrum C5-2002-1810-3
Wiley ID 1617771