CID 114342

63834-75-3

Structural Information

Molecular Formula
C13H26N2O4
SMILES
CCC(CC)(COC(=O)N(C)C)COC(=O)N(C)C
InChI
InChI=1S/C13H26N2O4/c1-7-13(8-2,9-18-11(16)14(3)4)10-19-12(17)15(5)6/h7-10H2,1-6H3
InChIKey
SYJOHJHUOWQNTH-UHFFFAOYSA-N
Compound name
[2-(dimethylcarbamoyloxymethyl)-2-ethylbutyl] N,N-dimethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.18927 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.19655 167.3
[M+Na]+ 297.17849 171.1
[M-H]- 273.18199 169.9
[M+NH4]+ 292.22309 184.5
[M+K]+ 313.15243 174.1
[M+H-H2O]+ 257.18653 160.9
[M+HCOO]- 319.18747 189.9
[M+CH3COO]- 333.20312 210.5
[M+Na-2H]- 295.16394 168.4
[M]+ 274.18872 174.6
[M]- 274.18982 174.6
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.