CID 4387212

Tert-butyl 4-oxoimidazolidine-1-carboxylate

Structural Information

Molecular Formula
C8H14N2O3
SMILES
CC(C)(C)OC(=O)N1CC(=O)NC1
InChI
InChI=1S/C8H14N2O3/c1-8(2,3)13-7(12)10-4-6(11)9-5-10/h4-5H2,1-3H3,(H,9,11)
InChIKey
VHHMYPLTJYOOMG-UHFFFAOYSA-N
Compound name
tert-butyl 4-oxoimidazolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

186.10045 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.10773 142.1
[M+Na]+ 209.08967 149.1
[M-H]- 185.09317 141.6
[M+NH4]+ 204.13427 160.5
[M+K]+ 225.06361 148.4
[M+H-H2O]+ 169.09771 136.2
[M+HCOO]- 231.09865 159.2
[M+CH3COO]- 245.11430 176.5
[M+Na-2H]- 207.07512 144.9
[M]+ 186.09990 140.6
[M]- 186.10100 140.6
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

patents stripe