| SpectraBase Spectrum ID |
KbccIj5jtnF |
| Name |
Trans-4A,9-dimethyl-7-methoxy-1,2,3,4,4A,9A-hexahydro-4-carbazolone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.141578854 u |
| Formula |
C15H19NO2 |
| InChI |
InChI=1S/C15H19NO2/c1-15-11-8-7-10(18-3)9-12(11)16(2)13(15)5-4-6-14(15)17/h7-9,13H,4-6H2,1-3H3/t13-,15+/m0/s1 |
| InChIKey |
ANFVAAOEBGVWCU-DZGCQCFKSA-N |
| Molecular Weight |
245.322 g/mol |
| SMILES |
[C@@]12(N(C=3C([C@]2(C(=O)CCC1)C)=CC=C(C3)OC)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909161 |
