| SpectraBase Spectrum ID |
JI7ygubtdHk |
| Name |
p-Anisylnitrile |
| CAS Registry Number |
874-90-8 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
133.052763848 u |
| Formula |
C8H7NO |
| InChI |
InChI=1S/C8H7NO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3 |
| InChIKey |
XDJAAZYHCCRJOK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
133.150 g/mol |
| Nominal Mass |
133 u |
| Quality |
983 |
| Retention Index |
1208 |
| SMILES |
C1(=CC=C(C=C1)OC)C#N |
| SPLASH |
splash10-0f89-8900000000-a88f1a81a50f9394d65c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Anisonitrile
m-Cyanoanisole
4-Methoxybenzonitrile |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004322 |
