| SpectraBase Spectrum ID |
CPdmipijV5k |
| Name |
Glutaric acid, 2,2,3,3-tetrafluoropropyl (2-naphthyl)methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.114121708 u |
| Formula |
C19H18F4O4 |
| InChI |
InChI=1S/C19H18F4O4/c20-18(21)19(22,23)12-27-17(25)7-3-6-16(24)26-11-13-8-9-14-4-1-2-5-15(14)10-13/h1-2,4-5,8-10,18H,3,6-7,11-12H2 |
| InChIKey |
QVJZDFSQSUUYSF-UHFFFAOYSA-N |
| Molecular Weight |
386.343 g/mol |
| SMILES |
C(CCC(OCC(C(F)F)(F)F)=O)C(OCC1=CC2=C(C=CC=C2)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897533 |
