CID 46344059

Tert-butyl 4-(2-oxoimidazolidin-1-yl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C13H23N3O3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)N2CCNC2=O
InChI
InChI=1S/C13H23N3O3/c1-13(2,3)19-12(18)15-7-4-10(5-8-15)16-9-6-14-11(16)17/h10H,4-9H2,1-3H3,(H,14,17)
InChIKey
NPTZWFCKLAFHIL-UHFFFAOYSA-N
Compound name
tert-butyl 4-(2-oxoimidazolidin-1-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

269.17395 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.18123 167.0
[M+Na]+ 292.16317 170.9
[M-H]- 268.16667 167.2
[M+NH4]+ 287.20777 180.2
[M+K]+ 308.13711 168.8
[M+H-H2O]+ 252.17121 158.9
[M+HCOO]- 314.17215 178.1
[M+CH3COO]- 328.18780 192.5
[M+Na-2H]- 290.14862 165.9
[M]+ 269.17340 161.4
[M]- 269.17450 161.4
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

patents stripe