| SpectraBase Spectrum ID |
2oCxYoMhGsQ |
| Name |
Succinic acid, hex-4-yn-3-yl 2-naphthylmethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.151809184 u |
| Formula |
C21H22O4 |
| InChI |
InChI=1S/C21H22O4/c1-3-7-19(4-2)25-21(23)13-12-20(22)24-15-16-10-11-17-8-5-6-9-18(17)14-16/h5-6,8-11,14,19H,4,12-13,15H2,1-2H3 |
| InChIKey |
SAYBQKRFNYXJFI-UHFFFAOYSA-N |
| Molecular Weight |
338.403 g/mol |
| SMILES |
C(CC(OC(CC)C#CC)=O)C(OCC=1C=C2C=CC=CC2=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.803688 |
