| SpectraBase Spectrum ID |
3ISPbCAclg7 |
| Name |
(E)-Ethyl 3'-(2,2-dimethyl-3-oxo-3-phenylpropanoyl)-4'-(3,3-dimethyltriaz-1-enyl)biphenyl-4-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
471.215806422 u |
| Formula |
C28H29N3O4 |
| InChI |
InChI=1S/C28H29N3O4/c1-6-35-27(34)21-14-12-19(13-15-21)22-16-17-24(29-30-31(4)5)23(18-22)26(33)28(2,3)25(32)20-10-8-7-9-11-20/h7-18H,6H2,1-5H3/b30-29+ |
| InChIKey |
LRPZZAZANWADNX-QVIHXGFCSA-N |
| Molecular Weight |
471.557 g/mol |
| SMILES |
C(C(C=1C=C(C=2C=CC(C(=O)OCC)=CC2)C=CC1\N=N\N(C)C)=O)(C(=O)C1=CC=CC=C1)(C)C |
