CID 103609

52235-20-8

Structural Information

Molecular Formula
C9H17N3
SMILES
CCC(C)(C#N)N=NC(C)(C)C
InChI
InChI=1S/C9H17N3/c1-6-9(5,7-10)12-11-8(2,3)4/h6H2,1-5H3
InChIKey
JZDHUYKBYNFYAB-UHFFFAOYSA-N
Compound name
2-(tert-butyldiazenyl)-2-methylbutanenitrile
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

606
Patents

167.14224 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.14952 142.7
[M+Na]+ 190.13146 150.4
[M-H]- 166.13496 146.0
[M+NH4]+ 185.17606 162.1
[M+K]+ 206.10540 151.6
[M+H-H2O]+ 150.13950 131.0
[M+HCOO]- 212.14044 163.7
[M+CH3COO]- 226.15609 202.4
[M+Na-2H]- 188.11691 149.9
[M]+ 167.14169 140.0
[M]- 167.14279 140.0
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