CID 20118748

2-(2-aminoethyl)-6-methoxyphenol

Structural Information

Molecular Formula
C9H13NO2
SMILES
COC1=CC=CC(=C1O)CCN
InChI
InChI=1S/C9H13NO2/c1-12-8-4-2-3-7(5-6-10)9(8)11/h2-4,11H,5-6,10H2,1H3
InChIKey
QKCSVOQSBJXICK-UHFFFAOYSA-N
Compound name
2-(2-aminoethyl)-6-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

167.09464 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.10192 134.6
[M+Na]+ 190.08386 146.3
[M+NH4]+ 185.12846 142.7
[M+K]+ 206.05780 140.6
[M-H]- 166.08736 136.6
[M+Na-2H]- 188.06931 140.6
[M]+ 167.09409 136.7
[M]- 167.09519 136.7
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