| SpectraBase Spectrum ID |
HcCABwlXWzP |
| Name |
Benzeneacetonitrile |
| CAS Registry Number |
140-29-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H7N |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| InChIKey |
SUSQOBVLVYHIEX-UHFFFAOYSA-N |
| Molecular Weight |
117.151 g/mol |
| SMILES |
c1cccc(c1)CC#N |
| SPLASH |
splash10-014i-9700000000-bf1d73f8cd3fbaf608c6 |
| Source |
ex MACA OIL, ex MARIO TELLEZ |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1885902 |
