CID 74314

5-amino-2-methoxyphenol

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

2
References

2974
Patents

139.06332 Da
Monoisotopic Mass

0.8
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