CID 12618671

2-{[(2-aminophenyl)methoxy]methyl}aniline

Structural Information

Molecular Formula
C14H16N2O
SMILES
C1=CC=C(C(=C1)COCC2=CC=CC=C2N)N
InChI
InChI=1S/C14H16N2O/c15-13-7-3-1-5-11(13)9-17-10-12-6-2-4-8-14(12)16/h1-8H,9-10,15-16H2
InChIKey
SZJBQSXXLJETCD-UHFFFAOYSA-N
Compound name
2-[(2-aminophenyl)methoxymethyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

177
Patents

228.12627 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.13355 151.2
[M+Na]+ 251.11549 158.0
[M-H]- 227.11899 157.2
[M+NH4]+ 246.16009 168.2
[M+K]+ 267.08943 153.9
[M+H-H2O]+ 211.12353 143.5
[M+HCOO]- 273.12447 176.7
[M+CH3COO]- 287.14012 195.0
[M+Na-2H]- 249.10094 156.6
[M]+ 228.12572 149.2
[M]- 228.12682 149.2
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