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Benzotriazol-4(5H)-one, 6,7-dihydro-1-(3-nitrophenyl)-
SpectraBase Compound ID 7JCc8YG78y6
InChI InChI=1S/C12H10N4O3/c17-11-6-2-5-10-12(11)13-14-15(10)8-3-1-4-9(7-8)16(18)19/h1,3-4,7H,2,5-6H2
InChIKey MMMGYOWEIQHJQK-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C12H10N4O3
Exact Mass 258.07529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NSjNXAG10
Name Benzotriazol-4(5H)-one, 6,7-dihydro-1-(3-nitrophenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4O3
InChI InChI=1S/C12H10N4O3/c17-11-6-2-5-10-12(11)13-14-15(10)8-3-1-4-9(7-8)16(18)19/h1,3-4,7H,2,5-6H2
InChIKey MMMGYOWEIQHJQK-UHFFFAOYSA-N
Molecular Weight 258.237 g/mol
SMILES c12c([n](-c3cc(N(=O)=O)ccc3)nn1)CCCC2=O
SPLASH splash10-0a6r-7910000000-003260e4aa1b248d19b6
Source of Spectrum AD-0-2532-0
Synonyms 1-(3-Nitrophenyl)-1,5,6,7-tetrahydro-4H-1,2,3-benzotriazol-4-one 1-(3-nitrophenyl)-6,7-dihydro-5H-benzotriazol-4-one
Wiley ID 1432255