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2-(3'-Nitrobenzyl)-4-trifluoromethylnitrobenzene
SpectraBase Compound ID FvSIpWFzXQN
InChI InChI=1S/C14H9F3N2O4/c15-14(16,17)11-4-5-13(19(22)23)10(8-11)6-9-2-1-3-12(7-9)18(20)21/h1-5,7-8H,6H2
InChIKey GGGXUJXXLVCZJL-UHFFFAOYSA-N
Mol Weight 326.23 g/mol
Molecular Formula C14H9F3N2O4
Exact Mass 326.051441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChYFz47gGg5
Name 2-(3'-Nitrobenzyl)-4-trifluoromethylnitrobenzene
Alternate Name(s) 1-Nitro-2-(3-nitrobenzyl)-4-(trifluoromethyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9F3N2O4
InChI InChI=1S/C14H9F3N2O4/c15-14(16,17)11-4-5-13(19(22)23)10(8-11)6-9-2-1-3-12(7-9)18(20)21/h1-5,7-8H,6H2
InChIKey GGGXUJXXLVCZJL-UHFFFAOYSA-N
Molecular Weight 326.231 g/mol
SMILES c1(c(cc(cc1)C(F)(F)F)Cc1cccc(c1)[N+](=O)[O-])[N+](=O)[O-]
SPLASH splash10-06w9-0298000000-4c09876471920316290d
Source of Spectrum ASC-361-SM12-12e
Wiley ID 1814057