| SpectraBase Spectrum ID |
44xJlAg00pG |
| Name |
[4-[(1S,2R,4S)-4-(hydroxymethyl)-2-isopropenyl-2-methyl-cyclobutyl]-2-methoxyphenyl]acetate |
| Appearance |
Colorles solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O4 |
| InChI |
InChI=1S/C18H24O4/c1-11(2)18(4)9-14(10-19)17(18)13-6-7-15(22-12(3)20)16(8-13)21-5/h6-8,14,17,19H,1,9-10H2,2-5H3/t14-,17-,18+/m1/s1 |
| InChIKey |
FKWVPAUCSAEPQT-OLMNPRSZSA-N |
| Instrument Name |
Thermo Scientific DFS-HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202001634 |
| Molecular Weight |
304.386 g/mol |
| Optical Rotation |
[a]D27 = +44 (c = 1, CH2Cl2) |
| Reported Formula |
C18H24O4 |
| SMILES |
OC[C@]1(C[C@]([C@@]1(c1cc(c(cc1)OC(=O)C)OC)[H])(C(C)=C)C)[H] |
| SPLASH |
splash10-001i-0910000000-672ba993a7bd55ca55ee |
| Sample Comments |
dr = 90:10, er = 96:4 |
| Source of Spectrum |
ACI-59-SM87-S14la |
| Thin-Layer Chromatography |
Rf = 0.16 (P/Et2O, 1:1) |
| Wiley ID |
1857982 |
![[4-[(1S,2R,4S)-4-(hydroxymethyl)-2-isopropenyl-2-methyl-cyclobutyl]-2-methoxyphenyl]acetate](/api/spectrum/44xJlAg00pG/structure.png?h=300&w=458 "[4-[(1S,2R,4S)-4-(hydroxymethyl)-2-isopropenyl-2-methyl-cyclobutyl]-2-methoxyphenyl]acetate")
