SpectraBase Spectrum ID |
OH2jRWnxiN |
Name |
Pyrido[2,1-A]isoindol-6(2H)-one, 1,10B-dihydro-10B-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
199.099714042 u |
Formula |
C13H13NO |
InChI |
InChI=1S/C13H13NO/c1-13-8-4-5-9-14(13)12(15)10-6-2-3-7-11(10)13/h2-3,5-7,9H,4,8H2,1H3 |
InChIKey |
ACDHPNMCDZAUDL-UHFFFAOYSA-N |
Molecular Weight |
199.253 g/mol |
SMILES |
C1(N2C(C=3C=CC=CC13)(CCC=C2)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878255 |