| SpectraBase Spectrum ID |
CEsJQZPBKhu |
| Name |
(1S,2S)-2-(1,3-dioxoisoindolin-2-yl)cyclopropane-1-carbonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
212.058577504 u |
| Formula |
C12H8N2O2 |
| InChI |
InChI=1S/C12H8N2O2/c13-6-7-5-10(7)14-11(15)8-3-1-2-4-9(8)12(14)16/h1-4,7,10H,5H2/t7-,10+/m1/s1 |
| InChIKey |
LFAVXNAIZGHUOA-XCBNKYQSSA-N |
| Instrument Name |
Shimadzu GC-2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201810059 |
| Molecular Weight |
212.208 g/mol |
| Quality |
27 |
| SMILES |
[C@]1(N2C(C3=C(C2=O)C=CC=C3)=O)([C@](C1)(C#N)[H])[H] |
| SPLASH |
splash10-0udi-0900000000-66b2636ffcdf0e537a21 |
| Sample Comments |
20% de, 59% ee |
| Source of Spectrum |
ACI-57-SM37-5e (DOI: 10.1002/anie.201810059) |
| Wiley ID |
1893638 |
