| SpectraBase Spectrum ID |
GwtIZJw1JtU |
| Name |
(1S,2S)-2-phenethylcyclopropane-1-carbonitrile |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
171.104799423 u |
| Formula |
C12H13N |
| InChI |
InChI=1S/C12H13N/c13-9-12-8-11(12)7-6-10-4-2-1-3-5-10/h1-5,11-12H,6-8H2/t11-,12+/m0/s1 |
| InChIKey |
GMEPMUVIWWXBQJ-NWDGAFQWSA-N |
| Instrument Name |
Shimadzu GC-2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201810059 |
| Molecular Weight |
171.243 g/mol |
| Quality |
15 |
| SMILES |
C([C@@]1([C@](C1)(C#N)[H])[H])CC1=CC=CC=C1 |
| SPLASH |
splash10-0006-9000000000-175c2e0750705e1ef362 |
| Sample Comments |
>99% de, 1% ee |
| Source of Spectrum |
ACI-57-SM36-5a (DOI: 10.1002/anie.201810059) |
| Wiley ID |
1893634 |
