| SpectraBase Spectrum ID |
Gb1ihUYld4f |
| Name |
(S)-2-(3-Cyanophenyl)-4-Isopropyloxazoline |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14N2O |
| InChI |
InChI=1S/C13H14N2O/c1-9(2)12-8-16-13(15-12)11-5-3-4-10(6-11)7-14/h3-6,9,12H,8H2,1-2H3/t12-/m1/s1 |
| InChIKey |
YPMIKWKQUDFKIV-GFCCVEGCSA-N |
| Instrument Name |
JEOL JMS-700 |
| Ionization Type |
EI |
| Molecular Weight |
214.268 g/mol |
| Optical Rotation |
25[a]589 = -71.9 (c = 1.0, CHCl3) |
| Reported Formula |
C13H14N2O |
| SMILES |
C=1(OC[C@@](N1)(C(C)C)[H])c1cc(ccc1)C#N |
| SPLASH |
splash10-00di-0900000000-3e226061f797e1cd3f13 |
| Source of Spectrum |
US20110098479A1 |
| Wiley ID |
1861763 |
