| SpectraBase Spectrum ID |
DkUe9Bnm6tc |
| Name |
4-Benzylpyrimidine |
| CAS Registry Number |
64660-82-8 |
| Classification |
Amphetamine impurity |
| 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 |
170.084398330 u |
| Formula |
C11H10N2 |
| InChI |
InChI=1S/C11H10N2/c1-2-4-10(5-3-1)8-11-6-7-12-9-13-11/h1-7,9H,8H2 |
| InChIKey |
BXACYQRHBZMYQH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
170.215 g/mol |
| Nominal Mass |
170 u |
| Quality |
903 |
| Retention Index |
1429 |
| SMILES |
C1(CC=2N=CN=CC2)=CC=CC=C1 |
| SPLASH |
splash10-014i-4900000000-176a6ccb01124ed8e34d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018272 |
