CID 13283

838-88-0

Structural Information

Molecular Formula
C15H18N2
SMILES
CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)C)N
InChI
InChI=1S/C15H18N2/c1-10-7-12(3-5-14(10)16)9-13-4-6-15(17)11(2)8-13/h3-8H,9,16-17H2,1-2H3
InChIKey
WECDUOXQLAIPQW-UHFFFAOYSA-N
Compound name
4-[(4-amino-3-methylphenyl)methyl]-2-methylaniline
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

14
References

15670
Patents

226.147 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.15428 153.8
[M+Na]+ 249.13622 167.9
[M+NH4]+ 244.18082 163.0
[M+K]+ 265.11016 159.9
[M-H]- 225.13972 160.3
[M+Na-2H]- 247.12167 162.7
[M]+ 226.14645 157.7
[M]- 226.14755 157.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe