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2-(3'-Nitrobenzyl)-3-nitrobenzonitrile
SpectraBase Compound ID GjiBFY87UVl
InChI InChI=1S/C14H9N3O4/c15-9-11-4-2-6-14(17(20)21)13(11)8-10-3-1-5-12(7-10)16(18)19/h1-7H,8H2
InChIKey BKGJXUDJOAVPBZ-UHFFFAOYSA-N
Mol Weight 283.24 g/mol
Molecular Formula C14H9N3O4
Exact Mass 283.059306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12nqyYqPwRo
Name 2-(3'-Nitrobenzyl)-3-nitrobenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9N3O4
InChI InChI=1S/C14H9N3O4/c15-9-11-4-2-6-14(17(20)21)13(11)8-10-3-1-5-12(7-10)16(18)19/h1-7H,8H2
InChIKey BKGJXUDJOAVPBZ-UHFFFAOYSA-N
Molecular Weight 283.243 g/mol
SMILES C(c1c(c(ccc1)[N+](=O)[O-])Cc1cc(ccc1)[N+](=O)[O-])#N
SPLASH splash10-00l6-0490000000-b0249e8defb4c2252738
Source of Spectrum ASC-361-SM11-10e2
Synonyms 3-Nitro-2-(3-nitrobenzyl)benzonitrile
Wiley ID 1814051