| SpectraBase Spectrum ID |
4xxR11y3rrA |
| Name |
2-Phenyl-2,3,3A,4-tetrahydrochromeno[4,3-C]pyrazole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.110613078 u |
| Formula |
C16H14N2O |
| InChI |
InChI=1S/C16H14N2O/c1-2-6-13(7-3-1)18-10-12-11-19-15-9-5-4-8-14(15)16(12)17-18/h1-9,12H,10-11H2 |
| InChIKey |
DATNOZAQAIEORG-UHFFFAOYSA-N |
| Molecular Weight |
250.301 g/mol |
| SMILES |
C1(N2N=C3C(C2)COC2=C3C=CC=C2)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92494 |
![2-Phenyl-2,3,3a,4-tetrahydrochromeno[4,3-c]pyrazole](/api/spectrum/4xxR11y3rrA/structure.png?h=300&w=458 "2-Phenyl-2,3,3a,4-tetrahydrochromeno[4,3-c]pyrazole")
