CID 212385

24269-46-3

Structural Information

Molecular Formula
C14H29N3O2
SMILES
CCCOC(=O)N1CCN(CC1)CCN(CC)CC
InChI
InChI=1S/C14H29N3O2/c1-4-13-19-14(18)17-11-9-16(10-12-17)8-7-15(5-2)6-3/h4-13H2,1-3H3
InChIKey
JJHHADYVCRUPTC-UHFFFAOYSA-N
Compound name
propyl 4-[2-(diethylamino)ethyl]piperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.22598 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.23326 169.8
[M+Na]+ 294.21520 172.3
[M-H]- 270.21870 170.3
[M+NH4]+ 289.25980 183.7
[M+K]+ 310.18914 171.9
[M+H-H2O]+ 254.22324 160.8
[M+HCOO]- 316.22418 186.9
[M+CH3COO]- 330.23983 205.0
[M+Na-2H]- 292.20065 170.1
[M]+ 271.22543 170.6
[M]- 271.22653 170.6
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.