| SpectraBase Spectrum ID |
9ON2H1f8Hkq |
| Name |
1H-Cyclopenta[E]-1,2,4-triazin-3(2H)-one, 4A-ethoxy-4,4A,5,6,7,7A-hexahydro-1-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.147726862 u |
| Formula |
C14H19N3O2 |
| InChI |
InChI=1S/C14H19N3O2/c1-2-19-14-10-6-9-12(14)17(16-13(18)15-14)11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3,(H2,15,16,18) |
| InChIKey |
FHFSZOKRLCYRFF-UHFFFAOYSA-N |
| SMILES |
C12(C(N(NC(N2)=O)C2=CC=CC=C2)CCC1)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.820212 |
![1H-Cyclopenta[E]-1,2,4-triazin-3(2H)-one, 4A-ethoxy-4,4A,5,6,7,7A-hexahydro-1-phenyl-](/api/spectrum/9ON2H1f8Hkq/structure.png?h=300&w=458 "1H-Cyclopenta[E]-1,2,4-triazin-3(2H)-one, 4A-ethoxy-4,4A,5,6,7,7A-hexahydro-1-phenyl-")
