CID 43184832

(4-chlorophenyl)(4-methylphenyl)methanamine

Structural Information

Molecular Formula
C14H14ClN
SMILES
CC1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)N
InChI
InChI=1S/C14H14ClN/c1-10-2-4-11(5-3-10)14(16)12-6-8-13(15)9-7-12/h2-9,14H,16H2,1H3
InChIKey
DKXNNYRMIUEUGE-UHFFFAOYSA-N
Compound name
(4-chlorophenyl)-(4-methylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.08148 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.08876 151.2
[M+Na]+ 254.07070 159.5
[M-H]- 230.07420 157.5
[M+NH4]+ 249.11530 169.6
[M+K]+ 270.04464 153.7
[M+H-H2O]+ 214.07874 145.0
[M+HCOO]- 276.07968 170.4
[M+CH3COO]- 290.09533 193.1
[M+Na-2H]- 252.05615 155.4
[M]+ 231.08093 151.0
[M]- 231.08203 151.0
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

No patent data available for this compound.