CID 106249

(dibutylamino)methanol

Structural Information

Molecular Formula
C9H21NO
SMILES
CCCCN(CCCC)CO
InChI
InChI=1S/C9H21NO/c1-3-5-7-10(9-11)8-6-4-2/h11H,3-9H2,1-2H3
InChIKey
JPMXTFALJXQHJL-UHFFFAOYSA-N
Compound name
(dibutylamino)methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

182
Patents

159.16231 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.16959 140.5
[M+Na]+ 182.15153 145.4
[M-H]- 158.15503 140.3
[M+NH4]+ 177.19613 161.3
[M+K]+ 198.12547 145.3
[M+H-H2O]+ 142.15957 135.1
[M+HCOO]- 204.16051 163.6
[M+CH3COO]- 218.17616 183.9
[M+Na-2H]- 180.13698 144.9
[M]+ 159.16176 142.9
[M]- 159.16286 142.9
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