| SpectraBase Spectrum ID |
BgLub4s3pcC |
| Name |
4-Methyl-9-phenyl-1-nitro-3,8,10-triaza-7-oxatricyclo[4.3.1.0(4,10)dodeca-2,8-diene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12N4O3 |
| InChI |
InChI=1S/C13H12N4O3/c1-12-7-10-16(12)13(8-14-12,17(18)19)11(15-20-10)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3/t10-,12-,13+/m0/s1 |
| InChIKey |
OXHXUHLPHUNZTO-WCFLWFBJSA-N |
| Molecular Weight |
272.264 g/mol |
| SMILES |
[C@]12(N3[C@](C)(N=C2)C[C@]3([H])ON=C1c1ccccc1)N(=O)=O |
| SPLASH |
splash10-0002-9000000000-9c5e88337e9957ba7a06 |
| Source of Spectrum |
F4-0-2699-12 |
| Wiley ID |
1618747 |
