| SpectraBase Spectrum ID |
KTI1QchiXNu |
| Name |
(1RS,2SR)-1-(phenylethynyl)-2-(prop-2-en-1-ylamino)cyclohexanol |
| Appearance |
Bright yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
255.162314299 u |
| Formula |
C17H21NO |
| InChI |
InChI=1S/C17H21NO/c1-2-14-18-16-10-6-7-12-17(16,19)13-11-15-8-4-3-5-9-15/h2-5,8-9,16,18-19H,1,6-7,10,12,14H2/t16-,17+/m1/s1 |
| InChIKey |
CCDAWCQGIYAPOK-SJORKVTESA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201600273 |
| Molecular Weight |
255.361 g/mol |
| Quality |
309 |
| SMILES |
N([C@@]1(CCCC[C@@]1(C#CC1=CC=CC=C1)O)[H])CC=C |
| SPLASH |
splash10-014m-9200000000-b4805410445b925f1782 |
| Source of Spectrum |
QE-22-SM5-1a' (DOI: 10.1002/chem.201600273) |
| Thin-Layer Chromatography |
0.18 (petroleum ether/EtOAc, 3:1) |
| Wiley ID |
1904880 |
