| SpectraBase Spectrum ID |
Cq2LWyVEHUS |
| Name |
Phthalimidomethyl 3-methoxybenzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.079372518 u |
| Formula |
C17H13NO5 |
| InChI |
InChI=1S/C17H13NO5/c1-22-12-6-4-5-11(9-12)17(21)23-10-18-15(19)13-7-2-3-8-14(13)16(18)20/h2-9H,10H2,1H3 |
| InChIKey |
HXDKUACPMFBXJY-UHFFFAOYSA-N |
| Molecular Weight |
311.293 g/mol |
| SMILES |
C1=CC2=C(C(N(C2=O)COC(C2=CC(OC)=CC=C2)=O)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840119 |
