CID 117504

Cyclopentane-1,1-dimethanol, dicarbamate

Structural Information

Molecular Formula
C9H16N2O4
SMILES
C1CCC(C1)(COC(=O)N)COC(=O)N
InChI
InChI=1S/C9H16N2O4/c10-7(12)14-5-9(3-1-2-4-9)6-15-8(11)13/h1-6H2,(H2,10,12)(H2,11,13)
InChIKey
OMRAPVPZNVLTSF-UHFFFAOYSA-N
Compound name
[1-(carbamoyloxymethyl)cyclopentyl]methyl carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.11101 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.11829 148.8
[M+Na]+ 239.10023 153.2
[M+NH4]+ 234.14483 155.4
[M+K]+ 255.07417 151.0
[M-H]- 215.10373 147.8
[M+Na-2H]- 237.08568 151.1
[M]+ 216.11046 148.5
[M]- 216.11156 148.5
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.