SpectraBase Spectrum ID |
LFASAcRNNj |
Name |
3-Carboxamido-8-chloro-1,2,3-triazolo[1,5-a]-(1,3,5)-benzotriazepin-5-one |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C10H7ClN6O2 |
InChI |
InChI=1S/C10H7ClN6O2/c11-4-1-2-6-5(3-4)13-10(19)14-9-7(8(12)18)15-16-17(6)9/h1-3H,(H2,12,18)(H2,13,14,19) |
InChIKey |
OOHFVESVTRMGKG-UHFFFAOYSA-N |
Molecular Weight |
278.659 g/mol |
SMILES |
NC(c1nn[n]-2c1NC(Nc1c2ccc(c1)Cl)=O)=O |
SPLASH |
splash10-0006-9020000000-fb3912fbab8742a0f0d4 |
Source of Spectrum |
Y-39-1295-5 |
Wiley ID |
1528707 |