CID 9587998

3a,6,7,7a-tetrahydro-4,7-ethano-1,5(4h)-indandione dioxime

Structural Information

Molecular Formula
C11H16N2O2
SMILES
C1CC\2C3CC/C(=N/O)/C3C1C/C2=N\O
InChI
InChI=1S/C11H16N2O2/c14-12-9-4-3-8-7-2-1-6(11(8)9)5-10(7)13-15/h6-8,11,14-15H,1-5H2/b12-9-,13-10+
InChIKey
JGKWCBUWDVZKOU-TVRQEHKRSA-N
Compound name
(NE)-N-[(3Z)-3-hydroxyimino-8-tricyclo[5.2.2.02,6]undecanylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.12119 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 138.3
[M+Na]+ 231.11041 142.0
[M-H]- 207.11391 137.5
[M+NH4]+ 226.15501 163.0
[M+K]+ 247.08435 139.3
[M+H-H2O]+ 191.11845 133.8
[M+HCOO]- 253.11939 152.5
[M+CH3COO]- 267.13504 149.1
[M+Na-2H]- 229.09586 146.9
[M]+ 208.12064 136.3
[M]- 208.12174 136.3
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.