CID 9587998

4,7-ethano-1,5(4h)-indandione, 3a,6,7,7a-tetrahydro-, 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]+ 209.128466 138.3
[M+Na]+ 231.110408 142.0
[M-H]- 207.113914 137.5
[M+NH4]+ 226.155013 163.0
[M+K]+ 247.084348 139.3
[M+H-H2O]+ 191.118450 133.8
[M+HCOO]- 253.119391 152.5
[M+CH3COO]- 267.135041 149.1
[M+Na-2H]- 229.095856 146.9
[M]+ 208.12064142 136.3
[M]- 208.12173858 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.