| SpectraBase Spectrum ID |
K4Oyzrt5U7w |
| Name |
Succinic acid, 3-methylbut-2-en-1-yl 2-isopropoxyphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.162373868 u |
| Formula |
C18H24O5 |
| InChI |
InChI=1S/C18H24O5/c1-13(2)11-12-21-17(19)9-10-18(20)23-16-8-6-5-7-15(16)22-14(3)4/h5-8,11,14H,9-10,12H2,1-4H3 |
| InChIKey |
PQBMVRLCQWQQAB-UHFFFAOYSA-N |
| Molecular Weight |
320.385 g/mol |
| SMILES |
C(CC(OCC=C(C)C)=O)C(OC=1C=CC=CC1OC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827776 |
