CID 69230535

Tert-butyl 2-oxoimidazolidine-4-carboxylate

Structural Information

Molecular Formula
C8H14N2O3
SMILES
CC(C)(C)OC(=O)C1CNC(=O)N1
InChI
InChI=1S/C8H14N2O3/c1-8(2,3)13-6(11)5-4-9-7(12)10-5/h5H,4H2,1-3H3,(H2,9,10,12)
InChIKey
QMQFQBITGIQPDH-UHFFFAOYSA-N
Compound name
tert-butyl 2-oxoimidazolidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

186.10045 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.107726 142.9
[M+Na]+ 209.089668 149.3
[M-H]- 185.093174 140.9
[M+NH4]+ 204.134273 160.4
[M+K]+ 225.063608 147.7
[M+H-H2O]+ 169.097710 137.1
[M+HCOO]- 231.098651 158.4
[M+CH3COO]- 245.114301 174.6
[M+Na-2H]- 207.075116 145.2
[M]+ 186.09990142 139.4
[M]- 186.10099858 139.4
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