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3-Nitro-N-[2,2,2-trifluoro-1-(1-methyl-1-imidazole-2-yl)-ethyl]aniline
SpectraBase Compound ID AzhgT7jVTYd
InChI InChI=1S/C12H11F3N4O2/c1-18-6-5-16-11(18)10(12(13,14)15)17-8-3-2-4-9(7-8)19(20)21/h2-7,10,17H,1H3
InChIKey SEXWHOAWOMXQKC-UHFFFAOYSA-N
Mol Weight 300.24 g/mol
Molecular Formula C12H11F3N4O2
Exact Mass 300.08341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GAKhpdr9ng
Name 3-Nitro-N-[2,2,2-trifluoro-1-(1-methyl-1-imidazole-2-yl)-ethyl]aniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11F3N4O2
InChI InChI=1S/C12H11F3N4O2/c1-18-6-5-16-11(18)10(12(13,14)15)17-8-3-2-4-9(7-8)19(20)21/h2-7,10,17H,1H3
InChIKey SEXWHOAWOMXQKC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000188
Molecular Weight 300.241 g/mol
SMILES N(C(c1[n](ccn1)C)C(F)(F)F)c1cc([N+]([O-])=O)ccc1
SPLASH splash10-0006-9031000000-80a22d5ee1119186b4fc
Source of Spectrum ASC-352-2823-7bj
Synonyms 3-Nitro-N-(2,2,2-trifluoro-1-(1-methyl-1H-imidazol-2-yl)ethyl)aniline
Wiley ID 1764039