CID 13078
1,1'-(chloromethylene)bis(4-chlorobenzene)
Structural Information
- Molecular Formula
- C13H9Cl3
- SMILES
- C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)Cl)Cl
- InChI
- InChI=1S/C13H9Cl3/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13H
- InChIKey
- LKBJQRZQDCMBBJ-UHFFFAOYSA-N
- Compound name
- 1-chloro-4-[chloro-(4-chlorophenyl)methyl]benzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 270.98428 | 153.0 |
[M+Na]+ | 292.96622 | 162.8 |
[M-H]- | 268.96972 | 157.7 |
[M+NH4]+ | 288.01082 | 170.7 |
[M+K]+ | 308.94016 | 155.6 |
[M+H-H2O]+ | 252.97426 | 148.2 |
[M+HCOO]- | 314.97520 | 161.5 |
[M+CH3COO]- | 328.99085 | 164.9 |
[M+Na-2H]- | 290.95167 | 156.6 |
[M]+ | 269.97645 | 155.6 |
[M]- | 269.97755 | 155.6 |