CID 60029

105838-77-5

Structural Information

Molecular Formula
C12H20N2O
SMILES
CCCN(C)CC(C1=CC(=CC=C1)N)O
InChI
InChI=1S/C12H20N2O/c1-3-7-14(2)9-12(15)10-5-4-6-11(13)8-10/h4-6,8,12,15H,3,7,9,13H2,1-2H3
InChIKey
GGRSNVCPKUTJON-UHFFFAOYSA-N
Compound name
1-(3-aminophenyl)-2-[methyl(propyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.15756 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.16484 149.9
[M+Na]+ 231.14678 159.5
[M+NH4]+ 226.19138 157.6
[M+K]+ 247.12072 154.1
[M-H]- 207.15028 152.6
[M+Na-2H]- 229.13223 155.3
[M]+ 208.15701 151.8
[M]- 208.15811 151.8
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

No patent data available for this compound.