CID 170219

2-methoxy-4-methylaniline

Structural Information

Molecular Formula
C8H11NO
SMILES
CC1=CC(=C(C=C1)N)OC
InChI
InChI=1S/C8H11NO/c1-6-3-4-7(9)8(5-6)10-2/h3-5H,9H2,1-2H3
InChIKey
CJJLEUQMMMLOFI-UHFFFAOYSA-N
Compound name
2-methoxy-4-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

477
Patents

137.08406 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.09134 126.2
[M+Na]+ 160.07328 135.2
[M-H]- 136.07678 130.2
[M+NH4]+ 155.11788 148.1
[M+K]+ 176.04722 133.7
[M+H-H2O]+ 120.08132 121.0
[M+HCOO]- 182.08226 151.8
[M+CH3COO]- 196.09791 176.7
[M+Na-2H]- 158.05873 132.9
[M]+ 137.08351 126.3
[M]- 137.08461 126.3
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.