CID 45285

Dioxamate

Structural Information

Molecular Formula
C15H29NO4
SMILES
CCCCCCCCCC1(OCC(O1)COC(=O)N)C
InChI
InChI=1S/C15H29NO4/c1-3-4-5-6-7-8-9-10-15(2)19-12-13(20-15)11-18-14(16)17/h13H,3-12H2,1-2H3,(H2,16,17)
InChIKey
OWCAKKIRPJUQFO-UHFFFAOYSA-N
Compound name
(2-methyl-2-nonyl-1,3-dioxolan-4-yl)methyl carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

83
Patents

287.20966 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.21694 171.6
[M+Na]+ 310.19888 177.9
[M+NH4]+ 305.24348 178.1
[M+K]+ 326.17282 173.6
[M-H]- 286.20238 173.5
[M+Na-2H]- 308.18433 172.4
[M]+ 287.20911 172.7
[M]- 287.21021 172.7
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

patents stripe