SpectraBase Spectrum ID |
LBsgGbarQpM |
Name |
2-(2-Methoxyethyl)-2,3-dihydrochromeno[3,4-C]pyrrol-1(4H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
245.105193344 u |
Formula |
C14H15NO3 |
InChI |
InChI=1S/C14H15NO3/c1-17-7-6-15-8-10-9-18-12-5-3-2-4-11(12)13(10)14(15)16/h2-5H,6-9H2,1H3 |
InChIKey |
LMRQKZFSDCZXIQ-UHFFFAOYSA-N |
Molecular Weight |
245.278 g/mol |
SMILES |
C12=C(CN(C2=O)CCOC)COC=2C1=CC=CC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966812 |