| SpectraBase Spectrum ID |
IweadfNvtsm |
| Name |
2-(4-methoxy-1,3-benzodioxol-5-yl)acetonitrile |
| Alternate Name(s) |
2-(4-methoxy-1,3-benzodioxol-5-yl)ethanenitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H9NO3 |
| InChI |
InChI=1S/C10H9NO3/c1-12-9-7(4-5-11)2-3-8-10(9)14-6-13-8/h2-3H,4,6H2,1H3 |
| InChIKey |
XBPOJZMTUBBJPY-UHFFFAOYSA-N |
| Molecular Weight |
191.186 g/mol |
| SMILES |
c12c(c(CC#N)ccc2OCO1)OC |
| SPLASH |
splash10-0006-0900000000-38e185116979e992870a |
| Source of Spectrum |
H1-43-1782-5 |
| Wiley ID |
757837 |
