CID 6454362

62201-67-6

Structural Information

Molecular Formula
C8H19NO2
SMILES
CCC(C)N(CCO)CCO
InChI
InChI=1S/C8H19NO2/c1-3-8(2)9(4-6-10)5-7-11/h8,10-11H,3-7H2,1-2H3
InChIKey
NSUHEKKWYUZSQN-UHFFFAOYSA-N
Compound name
2-[butan-2-yl(2-hydroxyethyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

233
Patents

161.14159 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.148866 140.0
[M+Na]+ 184.130808 144.6
[M-H]- 160.134314 138.5
[M+NH4]+ 179.175413 159.8
[M+K]+ 200.104748 144.7
[M+H-H2O]+ 144.138850 134.8
[M+HCOO]- 206.139791 161.1
[M+CH3COO]- 220.155441 181.0
[M+Na-2H]- 182.116256 143.0
[M]+ 161.14104142 140.9
[M]- 161.14213858 140.9
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