CID 213081

25462-30-0

Structural Information

Molecular Formula
C10H16N2O4
SMILES
C1CC(C=C1)C(COC(=O)N)COC(=O)N
InChI
InChI=1S/C10H16N2O4/c11-9(13)15-5-8(6-16-10(12)14)7-3-1-2-4-7/h1,3,7-8H,2,4-6H2,(H2,11,13)(H2,12,14)
InChIKey
WEYBRXWZNDZELR-UHFFFAOYSA-N
Compound name
(3-carbamoyloxy-2-cyclopent-2-en-1-ylpropyl) carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.11101 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.11829 152.0
[M+Na]+ 251.10023 155.5
[M-H]- 227.10373 153.9
[M+NH4]+ 246.14483 169.9
[M+K]+ 267.07417 155.5
[M+H-H2O]+ 211.10827 145.0
[M+HCOO]- 273.10921 174.4
[M+CH3COO]- 287.12486 191.3
[M+Na-2H]- 249.08568 151.3
[M]+ 228.11046 150.0
[M]- 228.11156 150.0
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

No patent data available for this compound.