| SpectraBase Spectrum ID |
LtfjIOEgqxm |
| Name |
3-(Hydroxymethyl)-5-methoxy-2,2-dimethyl-7-pentylchroman-4-one |
| Appearance |
Pale-yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H26O4 |
| InChI |
InChI=1S/C18H26O4/c1-5-6-7-8-12-9-14(21-4)16-15(10-12)22-18(2,3)13(11-19)17(16)20/h9-10,13,19H,5-8,11H2,1-4H3 |
| InChIKey |
XTIBZQMECADRQP-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/open.202000343 |
| Molecular Weight |
306.402 g/mol |
| Reported Formula |
C18H26O4 |
| SMILES |
OCC1C(c2c(cc(cc2OC1(C)C)CCCCC)OC)=O |
| SPLASH |
splash10-00fr-9500000000-c8d6a8b1186d1014fe3e |
| Source of Spectrum |
CHO-10-SM13-18b |
| Thin-Layer Chromatography |
Rf = 0.19 (CH/EtOAc, 1:1) |
| Wiley ID |
1865938 |
