SpectraBase Spectrum ID |
4NsJg8Np2Jf |
Name |
Norreticuline, N-formyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
343.141972775 u |
Formula |
C19H21NO5 |
InChI |
InChI=1S/C19H21NO5/c1-24-18-4-3-12(8-16(18)22)7-15-14-10-17(23)19(25-2)9-13(14)5-6-20(15)11-21/h3-4,8-11,15,22-23H,5-7H2,1-2H3 |
InChIKey |
QYKLIFNJBMPXQU-UHFFFAOYSA-N |
Molecular Weight |
343.379 g/mol |
SMILES |
C1=C2C(N(CCC2=CC(=C1O)OC)C=O)CC1=CC(=C(OC)C=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930124 |