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Benzene, (3-nitropropyl-2,2-D2)-

View entire compound with spectra: 2 MS (GC)

Benzene, (3-nitropropyl-2,2-D2)-
SpectraBase Compound ID LC1nBysEsnr
InChI InChI=1S/C9H11NO2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2/i4D2
InChIKey ZROLMSLMPMSLRM-APZFVMQVSA-N
Mol Weight 167.2 g/mol
Molecular Formula C9H9D2NO2
Exact Mass 167.091532 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KR0bvlKWJeB
Name Benzene, (3-nitropropyl-2,2-D2)-
CAS Registry Number 7137-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9D2NO2
InChI InChI=1S/C9H11NO2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2/i4D2
InChIKey ZROLMSLMPMSLRM-APZFVMQVSA-N
Molecular Weight 167.204 g/mol
SMILES C([N+]([O-])=O)C(Cc1ccccc1)([D])[D]
SPLASH splash10-0006-9200000000-0c74ae3c621c493e3e8a
Source of Spectrum N4-1968-81-910
Synonyms 3-Phenylnitropropane-Beta-D2
Wiley ID 1161382