CID 103593

(1,3-dimethoxy-1,3-dimethylbutyl)(1,1-dimethylethyl)diazene

Structural Information

Molecular Formula
C12H26N2O2
SMILES
CC(C)(C)N=NC(C)(CC(C)(C)OC)OC
InChI
InChI=1S/C12H26N2O2/c1-10(2,3)13-14-12(6,16-8)9-11(4,5)15-7/h9H2,1-8H3
InChIKey
NKEQVCIDZOYHPO-UHFFFAOYSA-N
Compound name
tert-butyl-(2,4-dimethoxy-4-methylpentan-2-yl)diazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

230.19943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.20671 156.4
[M+Na]+ 253.18865 162.1
[M-H]- 229.19215 159.5
[M+NH4]+ 248.23325 175.9
[M+K]+ 269.16259 163.7
[M+H-H2O]+ 213.19669 151.5
[M+HCOO]- 275.19763 179.4
[M+CH3COO]- 289.21328 203.4
[M+Na-2H]- 251.17410 164.6
[M]+ 230.19888 162.8
[M]- 230.19998 162.8
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