| SpectraBase Spectrum ID |
DHeo3NQ0Nzx |
| Name |
3-Hydroxy-5-methoxy-2,2-dimethyl-7-(2-phenylethyl)-3,4-dihydrochromene-8-carboxylic acid, 2me derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.193673997 u |
| Formula |
C23H28O5 |
| InChI |
InChI=1S/C23H28O5/c1-23(2)19(26-4)14-17-18(25-3)13-16(12-11-15-9-7-6-8-10-15)20(21(17)28-23)22(24)27-5/h6-10,13,19H,11-12,14H2,1-5H3 |
| InChIKey |
IMBJLYYRLVYSAE-UHFFFAOYSA-N |
| Molecular Weight |
384.472 g/mol |
| SMILES |
C1=CC=CC(=C1)CCC1=CC(=C2C(=C1C(OC)=O)OC(C(C2)OC)(C)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961466 |
