| SpectraBase Spectrum ID |
2RYCWjwdgu |
| Name |
(1S,2R)-2-(2-hydroxyethyl)cyclohexyl 2-nitrobenzoate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.126322711 u |
| Formula |
C15H19NO5 |
| InChI |
InChI=1S/C15H19NO5/c17-10-9-11-5-1-4-8-14(11)21-15(18)12-6-2-3-7-13(12)16(19)20/h2-3,6-7,11,14,17H,1,4-5,8-10H2/t11-,14+/m1/s1 |
| InChIKey |
FWSRHCKXSFFFFX-RISCZKNCSA-N |
| Instrument Name |
Agilent 7890A-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201801434 |
| Molecular Weight |
293.319 g/mol |
| Optical Rotation |
[a]D20 = +96.6 (c = 1.0, CH2Cl2) |
| Reported Formula |
C15H20NO5 |
| SMILES |
OCC[C@]1(CCCC[C@@]1(OC(C1=C(C=CC=C1)[N+]([O-])=O)=O)[H])[H] |
| SPLASH |
splash10-0pe9-9220000000-9f758abb4f1b9f0800b2 |
| Source of Spectrum |
QE-24-SM20-5g (DOI: 10.1002/chem.201801434) |
| Wiley ID |
1900263 |
