CID 73887

1490-19-3

Structural Information

Molecular Formula
C12H22N2O4
SMILES
CC(=O)OCC(C)(C)N=NC(C)(C)COC(=O)C
InChI
InChI=1S/C12H22N2O4/c1-9(15)17-7-11(3,4)13-14-12(5,6)8-18-10(2)16/h7-8H2,1-6H3
InChIKey
NGDDOAPNMGYAIF-UHFFFAOYSA-N
Compound name
[2-[(1-acetyloxy-2-methylpropan-2-yl)diazenyl]-2-methylpropyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

258.15796 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.16524 159.5
[M+Na]+ 281.14718 164.7
[M-H]- 257.15068 162.3
[M+NH4]+ 276.19178 177.3
[M+K]+ 297.12112 166.7
[M+H-H2O]+ 241.15522 153.8
[M+HCOO]- 303.15616 182.9
[M+CH3COO]- 317.17181 205.9
[M+Na-2H]- 279.13263 164.7
[M]+ 258.15741 166.5
[M]- 258.15851 166.5
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