CID 213087

25462-39-9

Structural Information

Molecular Formula
C9H16N2O4
SMILES
CC(CC=C)(COC(=O)N)COC(=O)N
InChI
InChI=1S/C9H16N2O4/c1-3-4-9(2,5-14-7(10)12)6-15-8(11)13/h3H,1,4-6H2,2H3,(H2,10,12)(H2,11,13)
InChIKey
JVAXHLUHJFLHDW-UHFFFAOYSA-N
Compound name
[2-(carbamoyloxymethyl)-2-methylpent-4-enyl] carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.11101 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.118286 148.7
[M+Na]+ 239.100228 153.7
[M-H]- 215.103734 147.7
[M+NH4]+ 234.144833 165.9
[M+K]+ 255.074168 153.5
[M+H-H2O]+ 199.108270 143.0
[M+HCOO]- 261.109211 170.3
[M+CH3COO]- 275.124861 190.9
[M+Na-2H]- 237.085676 150.9
[M]+ 216.11046142 149.0
[M]- 216.11155858 149.0
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

No patent data available for this compound.