CID 1121067

4-(2-methoxyphenoxy)aniline

Structural Information

Molecular Formula
C13H13NO2
SMILES
COC1=CC=CC=C1OC2=CC=C(C=C2)N
InChI
InChI=1S/C13H13NO2/c1-15-12-4-2-3-5-13(12)16-11-8-6-10(14)7-9-11/h2-9H,14H2,1H3
InChIKey
XFOFRBMGVDBINH-UHFFFAOYSA-N
Compound name
4-(2-methoxyphenoxy)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

208
Patents

215.09464 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.101916 145.9
[M+Na]+ 238.083858 153.9
[M-H]- 214.087364 152.7
[M+NH4]+ 233.128463 164.1
[M+K]+ 254.057798 151.0
[M+H-H2O]+ 198.091900 138.6
[M+HCOO]- 260.092841 171.6
[M+CH3COO]- 274.108491 189.6
[M+Na-2H]- 236.069306 152.5
[M]+ 215.09409142 146.6
[M]- 215.09518858 146.6
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