SpectraBase Spectrum ID |
4nZnPavPvMl |
Name |
5H-1,2,4-triazolo[4,3-b][1,2,4]triazepin-6(7H)-one, 8-methyl-3-[3-(4-nitrophenyl)propyl]- |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H16N6O3 |
InChI |
InChI=1S/C15H16N6O3/c1-10-9-14(22)19-20-13(17-18-15(20)16-10)4-2-3-11-5-7-12(8-6-11)21(23)24/h5-8H,2-4,9H2,1H3,(H,19,22) |
InChIKey |
DCFHOXMXDFBNLY-UHFFFAOYSA-N |
Molecular Weight |
328.332 g/mol |
SMILES |
N1C(CC(=Nc2[n]1c(nn2)CCCc1ccc(cc1)[N+]([O-])=O)C)=O |
SPLASH |
splash10-004i-4901000000-029327bfb513605afec1 |
Source of Spectrum |
JX-2015-3-486 |
Synonyms |
8-Methyl-3-(3-(4-nitrophenyl)propyl)-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazepin-6(7H)-one
8-Methyl-3-[3-(4-nitrophenyl)propyl]-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazepin-6(7H)-one |
Wiley ID |
1724051 |