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

742
Patents

167.14224 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.149516 142.7
[M+Na]+ 190.131458 150.4
[M-H]- 166.134964 146.0
[M+NH4]+ 185.176063 162.1
[M+K]+ 206.105398 151.6
[M+H-H2O]+ 150.139500 131.0
[M+HCOO]- 212.140441 163.7
[M+CH3COO]- 226.156091 202.4
[M+Na-2H]- 188.116906 149.9
[M]+ 167.14169142 140.0
[M]- 167.14278858 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