| SpectraBase Spectrum ID |
CeURF2K38yu |
| Name |
1,4-Pentadien-3-ol, 1-[5-[4-[(2-methoxyethoxy)methoxy]-3-[[(2-methoxyethoxy)methoxy]methyl]-2-butenyl]-2,6,6-trimethyl-1-cyclohexen-1-yl]-3-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
496.340003879 u |
| Formula |
C28H48O7 |
| InChI |
InChI=1S/C28H48O7/c1-8-28(5,29)14-13-26-23(2)9-11-25(27(26,3)4)12-10-24(19-34-21-32-17-15-30-6)20-35-22-33-18-16-31-7/h8,10,13-14,25,29H,1,9,11-12,15-22H2,2-7H3/b14-13+ |
| InChIKey |
FFFGDPPABPJJOD-BUHFOSPRSA-N |
| Molecular Weight |
496.685 g/mol |
| SMILES |
C=1(C(C(CC=C(COCOCCOC)COCOCCOC)CCC1C)(C)C)\C=C\C(C=C)(O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95437 |