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(3S)-3-(3-methylphenyl)-3-oxidanyl-propanenitrile

View entire compound with spectra: 1 MS (GC)

(3S)-3-(3-methylphenyl)-3-oxidanyl-propanenitrile
SpectraBase Compound ID 17LuP9XMLHg
InChI InChI=1S/C10H11NO/c1-8-3-2-4-9(7-8)10(12)5-6-11/h2-4,7,10,12H,5H2,1H3/t10-/m0/s1
InChIKey OYFDTBOJBCVCCT-JTQLQIEISA-N
Mol Weight 161.2 g/mol
Molecular Formula C10H11NO
Exact Mass 161.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETw892JftQI
Name (3S)-3-(3-methylphenyl)-3-oxidanyl-propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO
InChI InChI=1S/C10H11NO/c1-8-3-2-4-9(7-8)10(12)5-6-11/h2-4,7,10,12H,5H2,1H3/t10-/m0/s1
InChIKey OYFDTBOJBCVCCT-JTQLQIEISA-N
Molecular Weight 161.204 g/mol
SMILES O[C@](c1cc(C)ccc1)(CC#N)[H]
SPLASH splash10-00dl-5900000000-ec3a4c0210b074ac0ecf
Source of Spectrum QC-11-3698-2
Synonyms (3S)-3-hydroxy-3-(3-methylphenyl)propanenitrile (3S)-3-hydroxy-3-(m-tolyl)propanenitrile (3S)-3-hydroxy-3-(m-tolyl)propionitrile
Wiley ID 860062