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1H-Benzotriazole, 1-[(4-nitrophenyl)methyl]-
SpectraBase Compound ID J3sQEzhqudT
InChI InChI=1S/C13H10N4O2/c18-17(19)11-7-5-10(6-8-11)9-16-13-4-2-1-3-12(13)14-15-16/h1-8H,9H2
InChIKey ZVDRIJWDOUDSQX-UHFFFAOYSA-N
Mol Weight 254.25 g/mol
Molecular Formula C13H10N4O2
Exact Mass 254.080376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WbCMdHBoG
Name 1H-Benzotriazole, 1-[(4-nitrophenyl)methyl]-
Alternate Name(s) 1-(4-Nitrobenzyl)-1H-1,2,3-benzotriazole 1-(4-Nitrobenzyl)benzotriazole 1-(p-Nitrobenzyl)-1,2,3-benzotriazole 1-[(4-Nitrophenyl)methyl]benzotriazole 1H-Benzotriazole, 1-(p-nitrobenzyl)-
CAS Registry Number 27799-81-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N4O2
InChI InChI=1S/C13H10N4O2/c18-17(19)11-7-5-10(6-8-11)9-16-13-4-2-1-3-12(13)14-15-16/h1-8H,9H2
InChIKey ZVDRIJWDOUDSQX-UHFFFAOYSA-N
Molecular Weight 254.249 g/mol
SMILES c1ccc2c(c1)nn[n]2Cc1ccc(cc1)N(=O)=O
SPLASH splash10-004i-9530000000-03e55bfc898ae471d541
Source of Spectrum O-3-370-4
Wiley ID 1257456