CID 13668284

41374-20-3

Structural Information

Molecular Formula
C16H19NO
SMILES
CC1=CC(=C(C=C1)NC2=C(C=C(C=C2)OC)C)C
InChI
InChI=1S/C16H19NO/c1-11-5-7-15(12(2)9-11)17-16-8-6-14(18-4)10-13(16)3/h5-10,17H,1-4H3
InChIKey
ICYDPYVGYFLVFS-UHFFFAOYSA-N
Compound name
N-(4-methoxy-2-methylphenyl)-2,4-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

35
Patents

241.14667 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.153946 155.5
[M+Na]+ 264.135888 164.2
[M-H]- 240.139394 163.0
[M+NH4]+ 259.180493 173.6
[M+K]+ 280.109828 160.4
[M+H-H2O]+ 224.143930 148.2
[M+HCOO]- 286.144871 180.5
[M+CH3COO]- 300.160521 199.5
[M+Na-2H]- 262.121336 160.0
[M]+ 241.14612142 157.6
[M]- 241.14721858 157.6
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