CID 212407

24269-57-6

Structural Information

Molecular Formula
C13H25N3O3
SMILES
CCOC(=O)N1CCN(CC1)CCN2CCOCC2
InChI
InChI=1S/C13H25N3O3/c1-2-19-13(17)16-7-5-14(6-8-16)3-4-15-9-11-18-12-10-15/h2-12H2,1H3
InChIKey
YJDDGZOBSAIBTH-UHFFFAOYSA-N
Compound name
ethyl 4-(2-morpholin-4-ylethyl)piperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.1896 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.196876 167.8
[M+Na]+ 294.178818 169.6
[M-H]- 270.182324 168.7
[M+NH4]+ 289.223423 177.8
[M+K]+ 310.152758 169.2
[M+H-H2O]+ 254.186860 157.4
[M+HCOO]- 316.187801 178.6
[M+CH3COO]- 330.203451 195.5
[M+Na-2H]- 292.164266 169.0
[M]+ 271.18905142 163.2
[M]- 271.19014858 163.2
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.