CID 9574864

2,8-di(n-hydroxyamidino)dibenzofuran

Structural Information

Molecular Formula
C14H12N4O3
SMILES
C1=CC2=C(C3=C(O2)C=CC(=C3)/C(=N/O)/N)C=C1/C(=N/O)/N
InChI
InChI=1S/C14H12N4O3/c15-13(17-19)7-1-3-11-9(5-7)10-6-8(14(16)18-20)2-4-12(10)21-11/h1-6,19-20H,(H2,15,17)(H2,16,18)
InChIKey
AXKSMLVOXGWVQO-UHFFFAOYSA-N
Compound name
2-N',8-N'-dihydroxydibenzofuran-2,8-dicarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.09094 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.09822 159.7
[M+Na]+ 307.08016 167.7
[M-H]- 283.08366 166.0
[M+NH4]+ 302.12476 176.4
[M+K]+ 323.05410 165.4
[M+H-H2O]+ 267.08820 152.7
[M+HCOO]- 329.08914 185.2
[M+CH3COO]- 343.10479 209.8
[M+Na-2H]- 305.06561 166.4
[M]+ 284.09039 159.9
[M]- 284.09149 159.9
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

No patent data available for this compound.