CID 60028

105838-76-4

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.15756 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.16484 150.9
[M+Na]+ 231.14678 155.4
[M-H]- 207.15028 153.8
[M+NH4]+ 226.19138 168.9
[M+K]+ 247.12072 154.4
[M+H-H2O]+ 191.15482 144.2
[M+HCOO]- 253.15576 173.0
[M+CH3COO]- 267.17141 195.4
[M+Na-2H]- 229.13223 152.4
[M]+ 208.15701 149.2
[M]- 208.15811 149.2
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.