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4-Chloro-2-nitrobenzyl-a,a-D2 alcohol
SpectraBase Compound ID LKaequMmZMZ
InChI InChI=1S/C7H6ClNO3/c8-6-2-1-5(4-10)7(3-6)9(11)12/h1-3,10H,4H2/i4D2
InChIKey OAHGNOHGHOTZQU-APZFVMQVSA-N
Mol Weight 189.59 g/mol
Molecular Formula C7H4D2ClNO3
Exact Mass 189.016174 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbRTY8zVz9p
Name 4-Chloro-2-nitrobenzyl-a,a-D2 alcohol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4D2ClNO3
InChI InChI=1S/C7H6ClNO3/c8-6-2-1-5(4-10)7(3-6)9(11)12/h1-3,10H,4H2/i4D2
InChIKey OAHGNOHGHOTZQU-APZFVMQVSA-N
Literature Reference DOI 10.1021/ol070820h
Molecular Weight 189.594 g/mol
SMILES OC([D])(c1c([N+](=O)[O-])cc(cc1)Cl)[D]
SPLASH splash10-004i-9800000000-a94c7268f98f4380f613
Source of Spectrum A1-9-2649/SMS3-1f
Wiley ID 1758195