CID 135645

3,4'-diamino-4-methyldiphenylmethane

Structural Information

Molecular Formula
C14H16N2
SMILES
CC1=C(C=C(C=C1)CC2=CC=C(C=C2)N)N
InChI
InChI=1S/C14H16N2/c1-10-2-3-12(9-14(10)16)8-11-4-6-13(15)7-5-11/h2-7,9H,8,15-16H2,1H3
InChIKey
ZZWIUWXGJRSQIR-UHFFFAOYSA-N
Compound name
5-[(4-aminophenyl)methyl]-2-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

212.13135 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.138626 148.4
[M+Na]+ 235.120568 156.3
[M-H]- 211.124074 154.8
[M+NH4]+ 230.165173 166.5
[M+K]+ 251.094508 151.6
[M+H-H2O]+ 195.128610 141.2
[M+HCOO]- 257.129551 173.6
[M+CH3COO]- 271.145201 194.0
[M+Na-2H]- 233.106016 153.0
[M]+ 212.13080142 145.4
[M]- 212.13189858 145.4
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