| SpectraBase Spectrum ID |
DkwmZlPuNfg |
| Name |
(1S,2S)-2-methyl-2-(thiophen-3-yl)cyclopropane-1-carbonitrile |
| Appearance |
Brown liquid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
163.045570468 u |
| Formula |
C9H9NS |
| InChI |
InChI=1S/C9H9NS/c1-9(4-8(9)5-10)7-2-3-11-6-7/h2-3,6,8H,4H2,1H3/t8-,9-/m1/s1 |
| InChIKey |
NJOPEULNALSZBY-RKDXNWHRSA-N |
| Instrument Name |
Shimadzu GC-2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201810059 |
| Molecular Weight |
163.238 g/mol |
| SMILES |
C1([C@@]2([C@](C2)(C#N)[H])C)=CSC=C1 |
| SPLASH |
splash10-03di-0900000000-0774f85db5c019a8f767 |
| Sample Comments |
>99% de, 85% ee |
| Source of Spectrum |
ACI-57-SM35-3m (DOI: 10.1002/anie.201810059) |
| Wiley ID |
1893631 |
