CID 13053976

83056-79-5

Structural Information

Molecular Formula
C9H16N2O3
SMILES
CC(C)(C)OC(=O)[C@@H]1CN(C(=O)N1)C
InChI
InChI=1S/C9H16N2O3/c1-9(2,3)14-7(12)6-5-11(4)8(13)10-6/h6H,5H2,1-4H3,(H,10,13)/t6-/m0/s1
InChIKey
JHSLVEQWBDYFQN-LURJTMIESA-N
Compound name
tert-butyl (4S)-1-methyl-2-oxoimidazolidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

200.11609 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.12337 145.7
[M+Na]+ 223.10531 153.1
[M-H]- 199.10881 145.4
[M+NH4]+ 218.14991 163.7
[M+K]+ 239.07925 152.1
[M+H-H2O]+ 183.11335 140.0
[M+HCOO]- 245.11429 162.4
[M+CH3COO]- 259.12994 181.4
[M+Na-2H]- 221.09076 147.4
[M]+ 200.11554 145.0
[M]- 200.11664 145.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe