SpectraBase Spectrum ID |
K0qZh4jVkAY |
Name |
1,2,3,4,4A,8,9,14A-Octahydro-[1]benzazepino[3,2,1-jk]carbazole |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
275.167399680 u |
Formula |
C20H21N |
InChI |
InChI=1S/C20H21N/c1-3-10-18-14(6-1)12-13-15-7-5-9-17-16-8-2-4-11-19(16)21(18)20(15)17/h1,3,5-7,9-10,16,19H,2,4,8,11-13H2 |
InChIKey |
GDJFBOJJTCGVTO-UHFFFAOYSA-N |
SMILES |
C1C2C(C3=C4C(=CC=C3)CCC3=C(C=CC=C3)N24)CCC1 |
Spectrum/Structure Validation Score (Raman) |
0.953175 |