SpectraBase Spectrum ID |
DlseWFjkbSa |
Name |
o-Chlorobenzylmalononitrile |
CAS Registry Number |
40915-55-7 |
Classification |
Lacrimator |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
190.029775933 u |
Formula |
C10H7ClN2 |
InChI |
InChI=1S/C10H7ClN2/c11-10-4-2-1-3-9(10)5-8(6-12)7-13/h1-4,8H,5H2 |
InChIKey |
YETVIAIVJSRDFR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
190.633 g/mol |
Nominal Mass |
190 u |
Quality |
993 |
Retention Index |
1449 |
SMILES |
C=1(C(=CC=CC1)Cl)CC(C#N)C#N |
SPLASH |
splash10-004i-3900000000-99db45a79d67ddff9962 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Dihydro CS
2-[(2-Chlorophenyl)methyl]propanedinitrile |
Technique |
GC/MS |
Wiley ID |
DD2024_030699 |