CID 3025375

102584-87-2

Structural Information

Molecular Formula
C16H34N2O
SMILES
CCCC(CCC)C(=O)NCCN(CCC)CCC
InChI
InChI=1S/C16H34N2O/c1-5-9-15(10-6-2)16(19)17-11-14-18(12-7-3)13-8-4/h15H,5-14H2,1-4H3,(H,17,19)
InChIKey
JKXKSLIHZBKVNA-UHFFFAOYSA-N
Compound name
N-[2-(dipropylamino)ethyl]-2-propylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.26712 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.27440 176.2
[M+Na]+ 293.25634 177.6
[M-H]- 269.25984 176.2
[M+NH4]+ 288.30094 192.7
[M+K]+ 309.23028 176.9
[M+H-H2O]+ 253.26438 168.9
[M+HCOO]- 315.26532 197.7
[M+CH3COO]- 329.28097 212.6
[M+Na-2H]- 291.24179 175.0
[M]+ 270.26657 180.2
[M]- 270.26767 180.2
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.