CID 117203

25384-85-4

Structural Information

Molecular Formula
C13H24N2O4
SMILES
CCCC(C)(COC(=O)N)COC(=O)NCC(=C)C
InChI
InChI=1S/C13H24N2O4/c1-5-6-13(4,8-18-11(14)16)9-19-12(17)15-7-10(2)3/h2,5-9H2,1,3-4H3,(H2,14,16)(H,15,17)
InChIKey
RJQFSZABCNPBQY-UHFFFAOYSA-N
Compound name
[2-(carbamoyloxymethyl)-2-methylpentyl] N-(2-methylprop-2-enyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.1736 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.180876 167.0
[M+Na]+ 295.162818 170.2
[M-H]- 271.166324 166.0
[M+NH4]+ 290.207423 182.3
[M+K]+ 311.136758 170.0
[M+H-H2O]+ 255.170860 160.8
[M+HCOO]- 317.171801 187.0
[M+CH3COO]- 331.187451 203.8
[M+Na-2H]- 293.148266 167.1
[M]+ 272.17305142 169.2
[M]- 272.17414858 169.2
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.