| SpectraBase Spectrum ID |
7ny6xcX62gU |
| Name |
2-((1R,2S)-2-acetoxycyclohexyl)ethyl benzoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.151809184 u |
| Formula |
C17H22O4 |
| InChI |
InChI=1S/C17H22O4/c1-13(18)21-16-10-6-5-7-14(16)11-12-20-17(19)15-8-3-2-4-9-15/h2-4,8-9,14,16H,5-7,10-12H2,1H3/t14-,16+/m1/s1 |
| InChIKey |
IMXLMNLJWFKBGR-ZBFHGGJFSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201801434 |
| Optical Rotation |
[a]D20 = +19.1 (c = 1.0, CH2Cl2) |
| Quality |
142 |
| Reported Formula |
C17H22O4 |
| SMILES |
CC(=O)O[C@@]1([C@@](CCOC(C2=CC=CC=C2)=O)(CCCC1)[H])[H] |
| SPLASH |
splash10-0a6r-8900000000-4da895c663e0cfa09563 |
| Source of Spectrum |
QE-24-SM25-IVu (DOI: 10.1002/chem.201801434) |
| Wiley ID |
1900279 |
