CID 18006841

Benzenamine, 4-methoxy-2-methyl-n-(3-methylphenyl)-

Structural Information

Molecular Formula
C15H17NO
SMILES
CC1=CC(=CC=C1)NC2=C(C=C(C=C2)OC)C
InChI
InChI=1S/C15H17NO/c1-11-5-4-6-13(9-11)16-15-8-7-14(17-3)10-12(15)2/h4-10,16H,1-3H3
InChIKey
HPUWWBYYEMSPEM-UHFFFAOYSA-N
Compound name
4-methoxy-2-methyl-N-(3-methylphenyl)aniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

21
Patents

227.13101 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.138286 151.1
[M+Na]+ 250.120228 159.3
[M-H]- 226.123734 158.4
[M+NH4]+ 245.164833 169.4
[M+K]+ 266.094168 155.7
[M+H-H2O]+ 210.128270 143.8
[M+HCOO]- 272.129211 176.5
[M+CH3COO]- 286.144861 195.3
[M+Na-2H]- 248.105676 156.9
[M]+ 227.13046142 152.5
[M]- 227.13155858 152.5
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