| SpectraBase Spectrum ID |
1bsjFuPTLvw |
| Name |
(S)-4-(benzo[d][1,3]dioxol-5-yl)-2,3-dimethylbutan-2-ol |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.125594437 u |
| Formula |
C13H18O3 |
| InChI |
InChI=1S/C13H18O3/c1-9(13(2,3)14)6-10-4-5-11-12(7-10)16-8-15-11/h4-5,7,9,14H,6,8H2,1-3H3/t9-/m0/s1 |
| InChIKey |
FGOVAIBLTVVKGO-VIFPVBQESA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202214377 |
| Molecular Weight |
222.284 g/mol |
| Optical Rotation |
[a]D20 = +29.6 (c = 0.92, CHCl3) |
| Quality |
297 |
| Reported Formula |
C13H18O3 |
| SMILES |
OC([C@](CC=1C=CC2=C(C1)OCO2)(C)[H])(C)C |
| SPLASH |
splash10-000i-1910000000-f43f64dbb71fbff015a4 |
| Sample Comments |
91% ee |
| Source of Spectrum |
ACI-62-SM49-(S)-4b (DOI: 10.1002/anie.202214377) |
| Wiley ID |
1908236 |
![(S)-4-(benzo[d][1,3]dioxol-5-yl)-2,3-dimethylbutan-2-ol](/api/spectrum/1bsjFuPTLvw/structure.png?h=300&w=458 "(S)-4-(benzo[d][1,3]dioxol-5-yl)-2,3-dimethylbutan-2-ol")
