CID 21900383

2-(carbamoyloxy)propyl prop-2-enoate

Structural Information

Molecular Formula
C7H11NO4
SMILES
CC(COC(=O)C=C)OC(=O)N
InChI
InChI=1S/C7H11NO4/c1-3-6(9)11-4-5(2)12-7(8)10/h3,5H,1,4H2,2H3,(H2,8,10)
InChIKey
GJKMBIAJMOZQCG-UHFFFAOYSA-N
Compound name
2-carbamoyloxypropyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

139
Patents

173.0688 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.076076 136.3
[M+Na]+ 196.058018 142.5
[M-H]- 172.061524 136.1
[M+NH4]+ 191.102623 155.8
[M+K]+ 212.031958 143.1
[M+H-H2O]+ 156.066060 131.0
[M+HCOO]- 218.067001 158.8
[M+CH3COO]- 232.082651 180.9
[M+Na-2H]- 194.043466 138.3
[M]+ 173.06825142 137.7
[M]- 173.06934858 137.7
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