CID 208373

32058-57-4

Structural Information

Molecular Formula
C16H33NO2
SMILES
CCN(CC)CCCOC(=O)C(C)(C)CC(C)(C)C
InChI
InChI=1S/C16H33NO2/c1-8-17(9-2)11-10-12-19-14(18)16(6,7)13-15(3,4)5/h8-13H2,1-7H3
InChIKey
QUPIZGOGLWPLOG-UHFFFAOYSA-N
Compound name
3-(diethylamino)propyl 2,2,4,4-tetramethylpentanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.25113 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.25841 171.8
[M+Na]+ 294.24035 175.5
[M-H]- 270.24385 172.6
[M+NH4]+ 289.28495 189.2
[M+K]+ 310.21429 175.7
[M+H-H2O]+ 254.24839 166.5
[M+HCOO]- 316.24933 190.6
[M+CH3COO]- 330.26498 208.9
[M+Na-2H]- 292.22580 173.7
[M]+ 271.25058 177.9
[M]- 271.25168 177.9
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

No patent data available for this compound.