CID 110933

1,1'-(ethylimino)dipropan-2-ol

Structural Information

Molecular Formula
C8H19NO2
SMILES
CCN(CC(C)O)CC(C)O
InChI
InChI=1S/C8H19NO2/c1-4-9(5-7(2)10)6-8(3)11/h7-8,10-11H,4-6H2,1-3H3
InChIKey
QFPSWHHWTPBRCL-UHFFFAOYSA-N
Compound name
1-[ethyl(2-hydroxypropyl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

612
Patents

161.14159 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.148866 140.4
[M+Na]+ 184.130808 144.8
[M-H]- 160.134314 139.0
[M+NH4]+ 179.175413 160.2
[M+K]+ 200.104748 145.4
[M+H-H2O]+ 144.138850 135.3
[M+HCOO]- 206.139791 160.5
[M+CH3COO]- 220.155441 182.0
[M+Na-2H]- 182.116256 142.1
[M]+ 161.14104142 140.6
[M]- 161.14213858 140.6
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