CID 16212508

4-cyano-2,2,6,6-tetramethylpiperidine 1-oxyl free radical

Structural Information

Molecular Formula
C10H17N2O
SMILES
CC1(CC(CC(N1[O])(C)C)C#N)C
InChI
InChI=1S/C10H17N2O/c1-9(2)5-8(7-11)6-10(3,4)12(9)13/h8H,5-6H2,1-4H3
InChIKey
OCIQOBBYJWEKSA-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

181.1341 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.14138 133.4
[M+Na]+ 204.12332 144.3
[M-H]- 180.12682 136.4
[M+NH4]+ 199.16792 154.7
[M+K]+ 220.09726 141.9
[M+H-H2O]+ 164.13136 123.0
[M+HCOO]- 226.13230 149.6
[M+CH3COO]- 240.14795 196.0
[M+Na-2H]- 202.10877 139.2
[M]+ 181.13355 128.6
[M]- 181.13465 128.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe