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(3S,4S)-4-Hydroxy-3-methyldecanenitrile
SpectraBase Compound ID Dh9UOAxYX0O
InChI InChI=1S/C11H21NO/c1-3-4-5-6-7-11(13)10(2)8-9-12/h10-11,13H,3-8H2,1-2H3/t10-,11-/m0/s1
InChIKey JCXYBEXKVRNYAH-QWRGUYRKSA-N
Mol Weight 183.29 g/mol
Molecular Formula C11H21NO
Exact Mass 183.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AA9y6kAFrzT
Name (3S,4S)-4-Hydroxy-3-methyldecanenitrile
Alternate Name(s) (3S,4S)-3-methyl-4-oxidanyl-decanenitrile (3S,4S)-4-hydroxy-3-methyl-capronitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H21NO
InChI InChI=1S/C11H21NO/c1-3-4-5-6-7-11(13)10(2)8-9-12/h10-11,13H,3-8H2,1-2H3/t10-,11-/m0/s1
InChIKey JCXYBEXKVRNYAH-QWRGUYRKSA-N
Molecular Weight 183.295 g/mol
SMILES O[C@]([C@](CC#N)(C)[H])(CCCCCC)[H]
SPLASH splash10-066r-9300000000-be8b125a49fba5bb7602
Source of Spectrum J-67-3808-9
Wiley ID 1569980