| SpectraBase Spectrum ID |
PBFCDgraq |
| Name |
2-(benzo[d][1,3]dioxol-5-yl)acetonitrile |
| Appearance |
Light yellow oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
161.047678467 u |
| Formula |
C9H7NO2 |
| InChI |
InChI=1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2 |
| InChIKey |
ZQPBOYASBNAXOZ-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202216160 |
| Molecular Weight |
161.160 g/mol |
| Quality |
307 |
| SMILES |
C1=CC(=CC=2OCOC12)CC#N |
| SPLASH |
splash10-03di-1900000000-6e5fb32586a90c9582e6 |
| Source of Spectrum |
ACI-62-SM52-23 (DOI: 10.1002/anie.202216160) |
| Thin-Layer Chromatography |
0.30 (Cy/EtOAc, 5:1) |
| Wiley ID |
1908411 |
