| SpectraBase Spectrum ID |
JepgK8d23wc |
| Name |
Methyl 3-{2',5'-bis[(2''-methoxyethoxy)methoxy]phenyl}propanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
372.178417854 u |
| Formula |
C18H28O8 |
| InChI |
InChI=1S/C18H28O8/c1-20-8-10-23-13-25-16-5-6-17(26-14-24-11-9-21-2)15(12-16)4-7-18(19)22-3/h5-6,12H,4,7-11,13-14H2,1-3H3 |
| InChIKey |
RWTJDLIBPQBJRN-UHFFFAOYSA-N |
| Molecular Weight |
372.414 g/mol |
| SMILES |
C=1(C(=CC=C(C1)OCOCCOC)OCOCCOC)CCC(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9478 |