SpectraBase Spectrum ID |
8CBgoGXyvVc |
Name |
Propanedioic acid, (1,2-dihydro-3-methyl-4-phenyl-2-naphthalenyl)-, dimethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
350.151809184 u |
Formula |
C22H22O4 |
InChI |
InChI=1S/C22H22O4/c1-14-18(20(21(23)25-2)22(24)26-3)13-16-11-7-8-12-17(16)19(14)15-9-5-4-6-10-15/h4-12,18,20H,13H2,1-3H3 |
InChIKey |
SPSQRJQYUCGODE-UHFFFAOYSA-N |
Molecular Weight |
350.414 g/mol |
SMILES |
C12=C(C=CC=C2)CC(C(=C1C1=CC=CC=C1)C)C(C(OC)=O)C(OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901297 |