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Benzene, (2-nitropropyl-3,3,3-D3)-
SpectraBase Compound ID 67mnVxKT6Zn
InChI InChI=1S/C9H11NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/i1D3
InChIKey OQBJLKIDAPUHSY-FIBGUPNXSA-N
Mol Weight 168.21 g/mol
Molecular Formula C9H8D3NO2
Exact Mass 168.097809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LW9yM1mjIJV
Name Benzene, (2-nitropropyl-3,3,3-D3)-
CAS Registry Number 17322-34-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8D3NO2
InChI InChI=1S/C9H11NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/i1D3
InChIKey OQBJLKIDAPUHSY-FIBGUPNXSA-N
Molecular Weight 168.210 g/mol
SMILES C([N+]([O-])=O)(C([D])([D])[D])Cc1ccccc1
SPLASH splash10-006x-9400000000-cb67b5cf67143839afa5
Source of Spectrum N4-1968-97-106
Synonyms 1-Phenyl-2-nitropropane-beta'-D3
Wiley ID 1161368