CID 72246446

Tert-butyl 3-(carbamoylamino)pyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C10H19N3O3
SMILES
CC(C)(C)OC(=O)N1CCC(C1)NC(=O)N
InChI
InChI=1S/C10H19N3O3/c1-10(2,3)16-9(15)13-5-4-7(6-13)12-8(11)14/h7H,4-6H2,1-3H3,(H3,11,12,14)
InChIKey
FZLAMCXSIRSXBU-UHFFFAOYSA-N
Compound name
tert-butyl 3-(carbamoylamino)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

229.14264 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.14992 153.7
[M+Na]+ 252.13186 158.2
[M-H]- 228.13536 155.2
[M+NH4]+ 247.17646 171.3
[M+K]+ 268.10580 158.1
[M+H-H2O]+ 212.13990 147.3
[M+HCOO]- 274.14084 173.4
[M+CH3COO]- 288.15649 192.0
[M+Na-2H]- 250.11731 154.8
[M]+ 229.14209 150.9
[M]- 229.14319 150.9
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