| SpectraBase Spectrum ID |
G2MVocwyUcF |
| Name |
4-(Chloromethyl)pyridine |
| CAS Registry Number |
10445-91-7 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
127.018876897 u |
| Formula |
C6H6ClN |
| InChI |
InChI=1S/C6H6ClN/c7-5-6-1-3-8-4-2-6/h1-4H,5H2 |
| InChIKey |
WZIYCIBURCPKAR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
127.574 g/mol |
| Nominal Mass |
127 u |
| Quality |
771 |
| Retention Index |
947 |
| SMILES |
C1(=CC=NC=C1)CCl |
| SPLASH |
splash10-004l-9600000000-66b5aa020c280de431f8 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-(chloromethyl)pyridine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004865 |
