| SpectraBase Spectrum ID |
1tn4RVo7KiD |
| Name |
(7S)-7-Phenyl-2,3,6,7-tetrahydro-1H-pyrazolo[1,2-A]pyrazol-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
202.110613078 u |
| Formula |
C12H14N2O |
| InChI |
InChI=1S/C12H14N2O/c15-12-9-11(10-5-2-1-3-6-10)13-7-4-8-14(12)13/h1-3,5-6,11H,4,7-9H2/t11-/m0/s1 |
| InChIKey |
ABPFIIMYLOXBNV-NSHDSACASA-N |
| Molecular Weight |
202.257 g/mol |
| SMILES |
C1(N2N([C@@](C1)(C=1C=CC=CC1)[H])CCC2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965346 |
![(7S)-7-phenyl-2,3,6,7-tetrahydro-1H-pyrazolo[1,2-a]pyrazol-5-one](/api/spectrum/1tn4RVo7KiD/structure.png?h=300&w=458 "(7S)-7-phenyl-2,3,6,7-tetrahydro-1H-pyrazolo[1,2-a]pyrazol-5-one")
