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N-[(1R)-1-[(2-cyanoethylthio)methyl]-2-hydroxy-ethyl]carbamic acid tert-butyl ester
SpectraBase Compound ID HHmw4KydJSM
InChI InChI=1S/C11H20N2O3S/c1-11(2,3)16-10(15)13-9(7-14)8-17-6-4-5-12/h9,14H,4,6-8H2,1-3H3,(H,13,15)/t9-/m1/s1
InChIKey IQXGSXQKBDINOA-SECBINFHSA-N
Mol Weight 260.35 g/mol
Molecular Formula C11H20N2O3S
Exact Mass 260.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Jjt1oiLRM8
Name N-[(1R)-1-[(2-cyanoethylthio)methyl]-2-hydroxy-ethyl]carbamic acid tert-butyl ester
Alternate Name(s) N-[(2R)-1-(2-cyanoethylthio)-3-hydroxypropan-2-yl]carbamic acid tert-butyl ester tert-Butyl N-[(1R)-1-(2-cyanoethylsulfanylmethyl)-2-hydroxy-ethyl]carbamate tert-Butyl N-[(2R)-1-(2-cyanoethylsulfanyl)-3-hydroxypropan-2-yl]carbamate tert-Butyl N-[(2R)-1-(2-cyanoethylsulfanyl)-3-oxidanyl-propan-2-yl]carbamate
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Formula C11H20N2O3S
InChI InChI=1S/C11H20N2O3S/c1-11(2,3)16-10(15)13-9(7-14)8-17-6-4-5-12/h9,14H,4,6-8H2,1-3H3,(H,13,15)/t9-/m1/s1
InChIKey IQXGSXQKBDINOA-SECBINFHSA-N
Molecular Weight 260.352 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](CO)(CSCCC#N)[H]
SPLASH splash10-0a4i-9000000000-ee1fb60a87465570f41e
Source of Spectrum F-70-1990-14
Wiley ID 1596480