CID 122970

32813-95-9

Structural Information

Molecular Formula
C8H18N6O2
SMILES
CC(C)(C(=NO)N)N=NC(C)(C)C(=NO)N
InChI
InChI=1S/C8H18N6O2/c1-7(2,5(9)11-15)13-14-8(3,4)6(10)12-16/h15-16H,1-4H3,(H2,9,11)(H2,10,12)
InChIKey
CMIPCRJDHTUYMZ-UHFFFAOYSA-N
Compound name
2-[(1-amino-1-hydroxyimino-2-methylpropan-2-yl)diazenyl]-N'-hydroxy-2-methylpropanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

423
Patents

230.14912 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.15640 149.8
[M+Na]+ 253.13834 153.1
[M-H]- 229.14184 151.9
[M+NH4]+ 248.18294 166.4
[M+K]+ 269.11228 155.0
[M+H-H2O]+ 213.14638 142.7
[M+HCOO]- 275.14732 176.4
[M+CH3COO]- 289.16297 209.6
[M+Na-2H]- 251.12379 155.5
[M]+ 230.14857 146.6
[M]- 230.14967 146.6
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