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2,3-Dinitro-4-(trifluoromethyl)benzonitrile
SpectraBase Compound ID FGPYY0VhIz3
InChI InChI=1S/C8H2F3N3O4/c9-8(10,11)5-2-1-4(3-12)6(13(15)16)7(5)14(17)18/h1-2H
InChIKey AWUSFPUPPKGKMS-UHFFFAOYSA-N
Mol Weight 261.12 g/mol
Molecular Formula C8H2F3N3O4
Exact Mass 260.99974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5LbpKt0fUq4
Name 2,3-Dinitro-4-(trifluoromethyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H2F3N3O4
InChI InChI=1S/C8H2F3N3O4/c9-8(10,11)5-2-1-4(3-12)6(13(15)16)7(5)14(17)18/h1-2H
InChIKey AWUSFPUPPKGKMS-UHFFFAOYSA-N
Molecular Weight 261.116 g/mol
SMILES c1(c(N(=O)=O)c(C#N)ccc1C(F)(F)F)N(=O)=O
SPLASH splash10-02t9-2930000000-b9f3d8411dd778b9ba3f
Source of Spectrum KC-0-3084-0
Synonyms Dinitrotrifluoromethylbenzonitrile
Wiley ID 826671