| SpectraBase Spectrum ID |
H3nrlL3J8xp |
| Name |
3H-Cyclobut[B]indole, 3-benzoyl-2A,7B-dihydro-2A-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.115364106 u |
| Formula |
C18H15NO |
| InChI |
InChI=1S/C18H15NO/c1-18-12-11-15(18)14-9-5-6-10-16(14)19(18)17(20)13-7-3-2-4-8-13/h2-12,15H,1H3/t15-,18-/m1/s1 |
| InChIKey |
OQNRZNRZQJWOJF-CRAIPNDOSA-N |
| Molecular Weight |
261.324 g/mol |
| SMILES |
[C@]12(N(C3=C([C@@]2([H])C=C1)C=CC=C3)C(=O)C1=CC=CC=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908774 |
![3H-Cyclobut[b]indole, 3-benzoyl-2a,7b-dihydro-2a-methyl-](/api/spectrum/H3nrlL3J8xp/structure.png?h=300&w=458 "3H-Cyclobut[b]indole, 3-benzoyl-2a,7b-dihydro-2a-methyl-")
