CID 11196067

Bis(4-chlorophenyl)methanamine hydrochloride

Structural Information

Molecular Formula
C13H11Cl2N
SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)N)Cl
InChI
InChI=1S/C13H11Cl2N/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13H,16H2
InChIKey
XJEIUGUQDIKUSM-UHFFFAOYSA-N
Compound name
bis(4-chlorophenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

210
Patents

251.02686 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.03414 152.9
[M+Na]+ 274.01608 161.9
[M-H]- 250.01958 158.4
[M+NH4]+ 269.06068 170.8
[M+K]+ 289.99002 155.0
[M+H-H2O]+ 234.02412 147.4
[M+HCOO]- 296.02506 167.3
[M+CH3COO]- 310.04071 165.1
[M+Na-2H]- 272.00153 156.8
[M]+ 251.02631 153.6
[M]- 251.02741 153.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe