CID 11953516

3-amino-5-methoxyphenol

Structural Information

Molecular Formula
C7H9NO2
SMILES
COC1=CC(=CC(=C1)O)N
InChI
InChI=1S/C7H9NO2/c1-10-7-3-5(8)2-6(9)4-7/h2-4,9H,8H2,1H3
InChIKey
ILTCFIIXWWUIPC-UHFFFAOYSA-N
Compound name
3-amino-5-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

203
Patents

139.06332 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.07060 125.5
[M+Na]+ 162.05254 137.6
[M+NH4]+ 157.09714 133.9
[M+K]+ 178.02648 132.4
[M-H]- 138.05604 127.6
[M+Na-2H]- 160.03799 132.1
[M]+ 139.06277 127.7
[M]- 139.06387 127.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe