CID 3016949

2-amino-1-(4-methoxyphenyl)ethanol

Structural Information

Molecular Formula
C9H13NO2
SMILES
COC1=CC=C(C=C1)C(CN)O
InChI
InChI=1S/C9H13NO2/c1-12-8-4-2-7(3-5-8)9(11)6-10/h2-5,9,11H,6,10H2,1H3
InChIKey
LQEPONWCAMNCOY-UHFFFAOYSA-N
Compound name
2-amino-1-(4-methoxyphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

167.09464 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.10192 135.3
[M+Na]+ 190.08386 146.2
[M+NH4]+ 185.12846 143.2
[M+K]+ 206.05780 141.1
[M-H]- 166.08736 137.0
[M+Na-2H]- 188.06931 141.1
[M]+ 167.09409 137.1
[M]- 167.09519 137.1
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