CID 213087

2-allyl-2-methyl-1,3-propanediol dicarbamate

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]+ 217.11829 148.9
[M+Na]+ 239.10023 153.9
[M+NH4]+ 234.14483 152.7
[M+K]+ 255.07417 152.3
[M-H]- 215.10373 145.5
[M+Na-2H]- 237.08568 148.6
[M]+ 216.11046 147.9
[M]- 216.11156 147.9
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.