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]+ 229.118286 152.0
[M+Na]+ 251.100228 155.5
[M-H]- 227.103734 153.9
[M+NH4]+ 246.144833 169.9
[M+K]+ 267.074168 155.5
[M+H-H2O]+ 211.108270 145.0
[M+HCOO]- 273.109211 174.4
[M+CH3COO]- 287.124861 191.3
[M+Na-2H]- 249.085676 151.3
[M]+ 228.11046142 150.0
[M]- 228.11155858 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.