CID 5875588

5-vinylquinuclidin-2-one oxime

Structural Information

Molecular Formula
C9H14N2O
SMILES
C=CC1CN\2CCC1C/C2=N\O
InChI
InChI=1S/C9H14N2O/c1-2-7-6-11-4-3-8(7)5-9(11)10-12/h2,7-8,12H,1,3-6H2/b10-9+
InChIKey
NELURRSZUNZEMY-MDZDMXLPSA-N
Compound name
(NE)-N-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.11061 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.11789 134.2
[M+Na]+ 189.09983 139.1
[M-H]- 165.10333 129.7
[M+NH4]+ 184.14443 157.8
[M+K]+ 205.07377 136.6
[M+H-H2O]+ 149.10787 129.3
[M+HCOO]- 211.10881 146.7
[M+CH3COO]- 225.12446 144.9
[M+Na-2H]- 187.08528 145.5
[M]+ 166.11006 133.6
[M]- 166.11116 133.6
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

No patent data available for this compound.