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[1-13C]-3-Benzyloxy-2-hydroxypropionitrile
SpectraBase Compound ID Gs3DvtjNO9Q
InChI InChI=1S/C10H11NO2/c11-6-10(12)8-13-7-9-4-2-1-3-5-9/h1-5,10,12H,7-8H2/i6+1
InChIKey GYIQKOCXLVJCMS-PTQBSOBMSA-N
Mol Weight 178.2 g/mol
Molecular Formula C913CH11NO2
Exact Mass 178.082333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fl5b92WLY9G
Name [1-13C]-3-Benzyloxy-2-hydroxypropionitrile
Comments Original formula: C9[13C]H11NO2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO2
InChI InChI=1S/C10H11NO2/c11-6-10(12)8-13-7-9-4-2-1-3-5-9/h1-5,10,12H,7-8H2/i6+1
InChIKey GYIQKOCXLVJCMS-PTQBSOBMSA-N
Molecular Weight 178.195 g/mol
SMILES OC([13C]#N)COCc1ccccc1
SPLASH splash10-0006-9300000000-9c65969462a4d3613605
Source of Spectrum Y1-44-791-3
Synonyms 2-Hydroxy-3-phenylmethoxypropanenitrile 3-Benzyloxy-2-hydroxy-propanenitrile 2-Oxidanyl-3-phenylmethoxy-propanenitrile
Wiley ID 1621292