CID 212401

24269-54-3

Structural Information

Molecular Formula
C15H29N3O2
SMILES
CCOC(=O)N1CCN(CC1)CCNC2CCCCC2
InChI
InChI=1S/C15H29N3O2/c1-2-20-15(19)18-12-10-17(11-13-18)9-8-16-14-6-4-3-5-7-14/h14,16H,2-13H2,1H3
InChIKey
FFFCQAWQTNTDST-UHFFFAOYSA-N
Compound name
ethyl 4-[2-(cyclohexylamino)ethyl]piperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.22598 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.233256 171.8
[M+Na]+ 306.215198 171.7
[M-H]- 282.218704 173.0
[M+NH4]+ 301.259803 183.7
[M+K]+ 322.189138 169.5
[M+H-H2O]+ 266.223240 161.8
[M+HCOO]- 328.224181 185.0
[M+CH3COO]- 342.239831 201.4
[M+Na-2H]- 304.200646 171.8
[M]+ 283.22543142 164.6
[M]- 283.22652858 164.6
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.