SpectraBase Spectrum ID |
1dDNXOyqWRv |
Name |
9B-Allyl-8-methoxy-3-methyl-5,9B-dihydrobenz[E]indolin-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
269.141578854 u |
Formula |
C17H19NO2 |
InChI |
InChI=1S/C17H19NO2/c1-4-9-17-11-16(19)18(2)15(17)8-6-12-5-7-13(20-3)10-14(12)17/h4-5,7-8,10H,1,6,9,11H2,2-3H3 |
InChIKey |
CILAVGTVRIKXJR-UHFFFAOYSA-N |
SMILES |
C=12C=C(C=CC1CC=C1N(C(CC21CC=C)=O)C)OC |
Spectrum/Structure Validation Score (Raman) |
0.889103 |