CID 135470155

Acenaphthenequinone dioxime

Structural Information

Molecular Formula
C12H8N2O2
SMILES
C1=CC2=C3C(=C1)C(=NO)C(=NO)C3=CC=C2
InChI
InChI=1S/C12H8N2O2/c15-13-11-8-5-1-3-7-4-2-6-9(10(7)8)12(11)14-16/h1-6,15-16H
InChIKey
ZBHVKJFVTXXTEQ-UHFFFAOYSA-N
Compound name
N-(2-hydroxyiminoacenaphthylen-1-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

212.05858 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.065856 140.2
[M+Na]+ 235.047798 149.7
[M-H]- 211.051304 145.8
[M+NH4]+ 230.092403 163.0
[M+K]+ 251.021738 145.8
[M+H-H2O]+ 195.055840 134.5
[M+HCOO]- 257.056781 165.8
[M+CH3COO]- 271.072431 154.3
[M+Na-2H]- 233.033246 149.1
[M]+ 212.05803142 141.2
[M]- 212.05912858 141.2
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

patents stripe