CID 237567

(5-amino-2-methoxyphenyl)methanol

Structural Information

Molecular Formula
C8H11NO2
SMILES
COC1=C(C=C(C=C1)N)CO
InChI
InChI=1S/C8H11NO2/c1-11-8-3-2-7(9)4-6(8)5-10/h2-4,10H,5,9H2,1H3
InChIKey
GGIYQZBTVHNMLD-UHFFFAOYSA-N
Compound name
(5-amino-2-methoxyphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

116
Patents

153.07898 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.086256 130.1
[M+Na]+ 176.068198 138.5
[M-H]- 152.071704 132.5
[M+NH4]+ 171.112803 150.5
[M+K]+ 192.042138 136.5
[M+H-H2O]+ 136.076240 124.7
[M+HCOO]- 198.077181 154.3
[M+CH3COO]- 212.092831 176.2
[M+Na-2H]- 174.053646 136.1
[M]+ 153.07843142 129.6
[M]- 153.07952858 129.6
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