SpectraBase Spectrum ID |
GJCHqsuDbMS |
Name |
1H-Indolo[7A,1-A]isoquinoline, erythrinan deriv. |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
285.172878983 u |
Formula |
C18H23NO2 |
InChI |
InChI=1S/C18H23NO2/c1-20-16-11-13-6-9-19-10-7-14-5-3-4-8-18(14,19)15(13)12-17(16)21-2/h3-4,11-12,14H,5-10H2,1-2H3 |
InChIKey |
YTBYNQGGCXMJQD-UHFFFAOYSA-N |
SMILES |
C1=2C34N(CCC4CC=CC3)CCC1=CC(=C(C2)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816201 |