SpectraBase Spectrum ID |
9JKiC1RScFs |
Name |
1-(1-Methoxypropan-2-yloxy)propan-2-yl 2-chlorobenzoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
286.097186788 u |
Formula |
C14H19ClO4 |
InChI |
InChI=1S/C14H19ClO4/c1-10(8-17-3)18-9-11(2)19-14(16)12-6-4-5-7-13(12)15/h4-7,10-11H,8-9H2,1-3H3 |
InChIKey |
FTYAATMEBXYHFJ-UHFFFAOYSA-N |
SMILES |
COCC(OCC(OC(C1=CC=CC=C1Cl)=O)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925037 |