CID 4072797

4-methyl-n-[2-(4-methylphenoxy)ethyl]aniline

Structural Information

Molecular Formula
C16H19NO
SMILES
CC1=CC=C(C=C1)NCCOC2=CC=C(C=C2)C
InChI
InChI=1S/C16H19NO/c1-13-3-7-15(8-4-13)17-11-12-18-16-9-5-14(2)6-10-16/h3-10,17H,11-12H2,1-2H3
InChIKey
UTQITHMVPMEITM-UHFFFAOYSA-N
Compound name
4-methyl-N-[2-(4-methylphenoxy)ethyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.14667 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.15395 157.2
[M+Na]+ 264.13589 171.8
[M+NH4]+ 259.18049 166.5
[M+K]+ 280.10983 162.8
[M-H]- 240.13939 163.2
[M+Na-2H]- 262.12134 167.2
[M]+ 241.14612 161.1
[M]- 241.14722 161.1
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

No patent data available for this compound.