CID 882241

20261-65-8

Structural Information

Molecular Formula
C14H16N2
SMILES
CC1=C(C(=CC=C1)N)C2=C(C=CC=C2N)C
InChI
InChI=1S/C14H16N2/c1-9-5-3-7-11(15)13(9)14-10(2)6-4-8-12(14)16/h3-8H,15-16H2,1-2H3
InChIKey
MCUUKQCKNKUMBP-UHFFFAOYSA-N
Compound name
2-(2-amino-6-methylphenyl)-3-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

67
Patents

212.13135 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.13863 149.2
[M+Na]+ 235.12057 163.5
[M+NH4]+ 230.16517 158.5
[M+K]+ 251.09451 155.7
[M-H]- 211.12407 155.7
[M+Na-2H]- 233.10602 158.4
[M]+ 212.13080 153.1
[M]- 212.13190 153.1
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