| SpectraBase Spectrum ID |
FcopzfZBsNj |
| Name |
(1S,2R)-2-(2-hydroxyethyl)cyclohexyl 3-methoxybenzoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
278.151809184 u |
| Formula |
C16H22O4 |
| InChI |
InChI=1S/C16H22O4/c1-19-14-7-4-6-13(11-14)16(18)20-15-8-3-2-5-12(15)9-10-17/h4,6-7,11-12,15,17H,2-3,5,8-10H2,1H3/t12-,15+/m1/s1 |
| InChIKey |
JKAWPPFCDRYBLJ-DOMZBBRYSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201801434 |
| Molecular Weight |
278.348 g/mol |
| Optical Rotation |
[a]D20 = +49.4 (c = 1.0, CH2Cl2) |
| Quality |
289 |
| Reported Formula |
C16H23O4 |
| SMILES |
OCC[C@]1(CCCC[C@@]1(OC(C1=CC=CC(=C1)OC)=O)[H])[H] |
| SPLASH |
splash10-0kdr-9510000000-10bec241fb9ea53238a0 |
| Source of Spectrum |
QE-24-SM21-5i (DOI: 10.1002/chem.201801434) |
| Wiley ID |
1900264 |
