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(3R,4S)-4-(tert-Butoxycarbonylamino)-3-hydroxy-6-methylheptanenitrile
SpectraBase Compound ID I7WWXowsbvy
InChI InChI=1S/C13H24N2O3/c1-9(2)8-10(11(16)6-7-14)15-12(17)18-13(3,4)5/h9-11,16H,6,8H2,1-5H3,(H,15,17)/t10-,11+/m0/s1
InChIKey FUHVXGBFWOOWBS-WDEREUQCSA-N
Mol Weight 256.35 g/mol
Molecular Formula C13H24N2O3
Exact Mass 256.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 902wuLdwiTS
Name (3R,4S)-4-(tert-Butoxycarbonylamino)-3-hydroxy-6-methylheptanenitrile
Alternate Name(s) tert-Butyl (1S)-1-[(1R)-2-cyano-1-hydroxyethyl]-3-methylbutylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24N2O3
InChI InChI=1S/C13H24N2O3/c1-9(2)8-10(11(16)6-7-14)15-12(17)18-13(3,4)5/h9-11,16H,6,8H2,1-5H3,(H,15,17)/t10-,11+/m0/s1
InChIKey FUHVXGBFWOOWBS-WDEREUQCSA-N
Molecular Weight 256.346 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@]([C@@](CC#N)(O)[H])(CC(C)C)[H]
SPLASH splash10-053i-9500000000-dfe92e752fdff4331e1f
Source of Spectrum KD-14-552-9
Wiley ID 1635902