| SpectraBase Spectrum ID |
EbcfBCMELOq |
| Name |
1-Hydroxymethyl-1-[2,2-(ethylenedioxy)propyl]-2-(2-methoxy-5-methylphenyl)-2-methyl-cyclopentane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.214409442 u |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-15-6-7-17(22-4)16(12-15)18(2)8-5-9-20(18,14-21)13-19(3)23-10-11-24-19/h6-7,12,21H,5,8-11,13-14H2,1-4H3 |
| InChIKey |
GZOJKBCNNCZOCJ-UHFFFAOYSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
C1(C(CCC1)(C)C=1C(=CC=C(C1)C)OC)(CC1(C)OCCO1)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956862 |