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4-Phenyl-2-nitrobenzyl-a,a-D2 alcohol

View entire compound with spectra: 1 MS (GC)

4-Phenyl-2-nitrobenzyl-a,a-D2 alcohol
SpectraBase Compound ID 9fbxBCnHQfE
InChI InChI=1S/C13H11NO3/c15-9-12-7-6-11(8-13(12)14(16)17)10-4-2-1-3-5-10/h1-8,15H,9H2/i9D2
InChIKey CCHNOYYDFASZBP-KNXIQCGSSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H9D2NO3
Exact Mass 231.086447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dtw6eou4Du8
Name 4-Phenyl-2-nitrobenzyl-a,a-D2 alcohol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9D2NO3
InChI InChI=1S/C13H11NO3/c15-9-12-7-6-11(8-13(12)14(16)17)10-4-2-1-3-5-10/h1-8,15H,9H2/i9D2
InChIKey CCHNOYYDFASZBP-KNXIQCGSSA-N
Literature Reference DOI 10.1021/ol070820h
Molecular Weight 231.247 g/mol
SMILES OC([D])(c1c(cc(-c2ccccc2)cc1)[N+](=O)[O-])[D]
SPLASH splash10-0uxr-0920000000-0c7322129780cbc7ddbd
Source of Spectrum A1-9-2649/SMS4-1h
Wiley ID 1758197