CID 22660951

[bis(4-chlorophenyl)methyl](methyl)amine

Structural Information

Molecular Formula
C14H13Cl2N
SMILES
CNC(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H13Cl2N/c1-17-14(10-2-6-12(15)7-3-10)11-4-8-13(16)9-5-11/h2-9,14,17H,1H3
InChIKey
PJXQWGJZSHIKTF-UHFFFAOYSA-N
Compound name
1,1-bis(4-chlorophenyl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

265.0425 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.049776 156.9
[M+Na]+ 288.031718 165.5
[M-H]- 264.035224 162.8
[M+NH4]+ 283.076323 174.6
[M+K]+ 304.005658 158.8
[M+H-H2O]+ 248.039760 151.2
[M+HCOO]- 310.040701 171.6
[M+CH3COO]- 324.056351 198.2
[M+Na-2H]- 286.017166 161.3
[M]+ 265.04195142 159.0
[M]- 265.04304858 159.0
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