CID 75763

2589-57-3

Structural Information

Molecular Formula
C10H18N2O4
SMILES
CC(C)(C(=O)OC)N=NC(C)(C)C(=O)OC
InChI
InChI=1S/C10H18N2O4/c1-9(2,7(13)15-5)11-12-10(3,4)8(14)16-6/h1-6H3
InChIKey
ZQMHJBXHRFJKOT-UHFFFAOYSA-N
Compound name
methyl 2-[(1-methoxy-2-methyl-1-oxopropan-2-yl)diazenyl]-2-methylpropanoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

2
References

43181
Patents

230.12666 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.133936 150.0
[M+Na]+ 253.115878 156.1
[M-H]- 229.119384 153.3
[M+NH4]+ 248.160483 169.0
[M+K]+ 269.089818 158.6
[M+H-H2O]+ 213.123920 144.8
[M+HCOO]- 275.124861 174.2
[M+CH3COO]- 289.140511 199.9
[M+Na-2H]- 251.101326 156.3
[M]+ 230.12611142 156.3
[M]- 230.12720858 156.3
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

patents stripe