SpectraBase Spectrum ID |
EagFA7olPZ5 |
Name |
Pyrrol4-[1-(4-methoxycarbonylmethoxy-phenyl)-1-methyl-ethyl]-phenoxymorpho-acetic acid, methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
372.157288487 u |
Formula |
C21H24O6 |
InChI |
InChI=1S/C21H24O6/c1-21(2,15-5-9-17(10-6-15)26-13-19(22)24-3)16-7-11-18(12-8-16)27-14-20(23)25-4/h5-12H,13-14H2,1-4H3 |
InChIKey |
YDJDXUVAHLYULV-UHFFFAOYSA-N |
Molecular Weight |
372.417 g/mol |
SMILES |
C(C1=CC=C(C=C1)OCC(=O)OC)(C1=CC=C(C=C1)OCC(=O)OC)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973261 |