| SpectraBase Spectrum ID |
99186SRPZ4C |
| Name |
Succinic acid, hex-4-yn-3-yl 2-naphthyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.136159120 u |
| Formula |
C20H20O4 |
| InChI |
InChI=1S/C20H20O4/c1-3-7-17(4-2)23-19(21)12-13-20(22)24-18-11-10-15-8-5-6-9-16(15)14-18/h5-6,8-11,14,17H,4,12-13H2,1-2H3 |
| InChIKey |
CHSFISYWMDEMKO-UHFFFAOYSA-N |
| Molecular Weight |
324.376 g/mol |
| SMILES |
C(CC(OC(CC)C#CC)=O)C(OC=1C=CC2=C(C1)C=CC=C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935832 |
