CID 96116

2644-26-0

Structural Information

Molecular Formula
C14H29NO2
SMILES
CCCCCN(CCCCC)CC(=O)OCC
InChI
InChI=1S/C14H29NO2/c1-4-7-9-11-15(12-10-8-5-2)13-14(16)17-6-3/h4-13H2,1-3H3
InChIKey
JFBWZQGMDBYSIH-UHFFFAOYSA-N
Compound name
ethyl 2-(dipentylamino)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.21983 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.22711 163.0
[M+Na]+ 266.20905 170.7
[M+NH4]+ 261.25365 169.3
[M+K]+ 282.18299 164.5
[M-H]- 242.21255 162.4
[M+Na-2H]- 264.19450 164.6
[M]+ 243.21928 163.6
[M]- 243.22038 163.6
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

No patent data available for this compound.