CID 7621

2-(dibutylamino)ethanol

Structural Information

Molecular Formula
C10H23NO
SMILES
CCCCN(CCCC)CCO
InChI
InChI=1S/C10H23NO/c1-3-5-7-11(9-10-12)8-6-4-2/h12H,3-10H2,1-2H3
InChIKey
IWSZDQRGNFLMJS-UHFFFAOYSA-N
Compound name
2-(dibutylamino)ethanol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

29
References

11187
Patents

173.17796 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.18524 143.2
[M+Na]+ 196.16718 151.8
[M+NH4]+ 191.21178 150.7
[M+K]+ 212.14112 145.7
[M-H]- 172.17068 143.2
[M+Na-2H]- 194.15263 146.2
[M]+ 173.17741 144.1
[M]- 173.17851 144.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe