CID 27492

Vinyl carbamate

Structural Information

Molecular Formula
C3H5NO2
SMILES
C=COC(=O)N
InChI
InChI=1S/C3H5NO2/c1-2-6-3(4)5/h2H,1H2,(H2,4,5)
InChIKey
LVLANIHJQRZTPY-UHFFFAOYSA-N
Compound name
ethenyl carbamate
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

94
References

12670
Patents

87.03203 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.039306 113.1
[M+Na]+ 110.02125 121.2
[M-H]- 86.024754 113.5
[M+NH4]+ 105.06585 136.3
[M+K]+ 125.99519 121.5
[M+H-H2O]+ 70.029290 108.9
[M+HCOO]- 132.03023 138.2
[M+CH3COO]- 146.04588 164.3
[M+Na-2H]- 108.00670 119.7
[M]+ 87.031481 112.2
[M]- 87.032579 112.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe