CID 69496

2,2,6,6-tetramethyl-1-nitroso-4-piperidone

Structural Information

Molecular Formula
C9H16N2O2
SMILES
CC1(CC(=O)CC(N1N=O)(C)C)C
InChI
InChI=1S/C9H16N2O2/c1-8(2)5-7(12)6-9(3,4)11(8)10-13/h5-6H2,1-4H3
InChIKey
PBOJDTWOZVDRPH-UHFFFAOYSA-N
Compound name
2,2,6,6-tetramethyl-1-nitrosopiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

184.12119 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.128466 134.4
[M+Na]+ 207.110408 143.5
[M-H]- 183.113914 138.7
[M+NH4]+ 202.155013 158.0
[M+K]+ 223.084348 143.6
[M+H-H2O]+ 167.118450 129.9
[M+HCOO]- 229.119391 156.8
[M+CH3COO]- 243.135041 187.6
[M+Na-2H]- 205.095856 141.4
[M]+ 184.12064142 135.2
[M]- 184.12173858 135.2
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