| SpectraBase Spectrum ID |
7HDcmGCcFrt |
| Name |
Glutaric acid, 2,2-dichloroethyl 1-naphthyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.042564391 u |
| Formula |
C17H16Cl2O4 |
| InChI |
InChI=1S/C17H16Cl2O4/c18-15(19)11-22-16(20)9-4-10-17(21)23-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15H,4,9-11H2 |
| InChIKey |
XAJYBUQLAGXQES-UHFFFAOYSA-N |
| Molecular Weight |
355.217 g/mol |
| SMILES |
C(CCC(OCC(Cl)Cl)=O)C(OC=1C2=C(C=CC1)C=CC=C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.848174 |
