CID 3040149

51733-97-2

Structural Information

Molecular Formula
C15H33NO2
SMILES
CCCCN(CCCC)CC(COCCCC)O
InChI
InChI=1S/C15H33NO2/c1-4-7-10-16(11-8-5-2)13-15(17)14-18-12-9-6-3/h15,17H,4-14H2,1-3H3
InChIKey
WWOYTPYZWJKMJW-UHFFFAOYSA-N
Compound name
1-butoxy-3-(dibutylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.25113 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.25841 171.7
[M+Na]+ 282.24035 173.7
[M-H]- 258.24385 170.3
[M+NH4]+ 277.28495 188.3
[M+K]+ 298.21429 173.0
[M+H-H2O]+ 242.24839 164.9
[M+HCOO]- 304.24933 192.0
[M+CH3COO]- 318.26498 204.7
[M+Na-2H]- 280.22580 171.5
[M]+ 259.25058 177.1
[M]- 259.25168 177.1
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.