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4-[1'-(2-Ethylimidazyl)]-7-nitrobenzo-2,1,3-oxadiazole
SpectraBase Compound ID LhhnUgfBZ8g
InChI InChI=1S/C11H9N5O3/c1-2-9-12-5-6-15(9)7-3-4-8(16(17)18)11-10(7)13-19-14-11/h3-6H,2H2,1H3
InChIKey TZHPBABSWNXANP-UHFFFAOYSA-N
Mol Weight 259.22 g/mol
Molecular Formula C11H9N5O3
Exact Mass 259.070539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4kdrgvl5loh
Name 4-[1'-(2-Ethylimidazyl)]-7-nitrobenzo-2,1,3-oxadiazole
CAS Registry Number 91485-31-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N5O3
InChI InChI=1S/C11H9N5O3/c1-2-9-12-5-6-15(9)7-3-4-8(16(17)18)11-10(7)13-19-14-11/h3-6H,2H2,1H3
InChIKey TZHPBABSWNXANP-UHFFFAOYSA-N
Molecular Weight 259.225 g/mol
SMILES c12c(c(-[n]3c(ncc3)CC)ccc1N(=O)=O)non2
SPLASH splash10-0kuu-9340000000-62ec6d516c993059eafe
Source of Spectrum W5-1989-35644-29892
Synonyms 4-(2-Ethyl-1H-imidazol-1-yl)-7-nitro-2,1,3-benzoxadiazole 7-(2-Ethyl-1-imidazolyl)-4-nitro-2,1,3-benzoxadiazole 7-(2-Ethylimidazol-1-yl)-4-nitro-2,1,3-benzoxadiazole
Wiley ID 1262491