CID 131862396

2-amino-5-(4-amino-3-methoxyphenyl)phenol

Structural Information

Molecular Formula
C13H14N2O2
SMILES
COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)O)N
InChI
InChI=1S/C13H14N2O2/c1-17-13-7-9(3-5-11(13)15)8-2-4-10(14)12(16)6-8/h2-7,16H,14-15H2,1H3
InChIKey
JQSCOPQWPVETTC-UHFFFAOYSA-N
Compound name
2-amino-5-(4-amino-3-methoxyphenyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

230.10553 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.11281 150.9
[M+Na]+ 253.09475 159.5
[M-H]- 229.09825 156.4
[M+NH4]+ 248.13935 167.6
[M+K]+ 269.06869 155.4
[M+H-H2O]+ 213.10279 143.8
[M+HCOO]- 275.10373 175.3
[M+CH3COO]- 289.11938 194.2
[M+Na-2H]- 251.08020 154.7
[M]+ 230.10498 148.9
[M]- 230.10608 148.9
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.