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Benzene, (2-nitropropyl-1,1-D2)-
SpectraBase Compound ID 44JpH0yzrHO
InChI InChI=1S/C9H11NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/i7D2
InChIKey OQBJLKIDAPUHSY-RJSZUWSASA-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 96diUd5mITp
Name Benzene, (2-nitropropyl-1,1-D2)-
Alternate Name(s) .beta.-D2-1-Phenyl-2-nitropropane
CAS Registry Number 23088-48-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9D2NO2
InChI InChI=1S/C9H11NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/i7D2
InChIKey OQBJLKIDAPUHSY-RJSZUWSASA-N
Molecular Weight 167.204 g/mol
SMILES C(N(=O)=O)(C(c1ccccc1)([D])[D])C
SPLASH splash10-0006-9300000000-9d021b5a44f27d300ee8
Source of Spectrum O-2-1681-6
Wiley ID 14064