CID 458863

Dibenzo[b,d]furan-2,3-diamine

Structural Information

Molecular Formula
C12H10N2O
SMILES
C1=CC=C2C(=C1)C3=CC(=C(C=C3O2)N)N
InChI
InChI=1S/C12H10N2O/c13-9-5-8-7-3-1-2-4-11(7)15-12(8)6-10(9)14/h1-6H,13-14H2
InChIKey
MBMZZCSGLBNFEA-UHFFFAOYSA-N
Compound name
dibenzofuran-2,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

198.07932 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.08660 138.4
[M+Na]+ 221.06854 149.6
[M-H]- 197.07204 145.0
[M+NH4]+ 216.11314 160.0
[M+K]+ 237.04248 146.1
[M+H-H2O]+ 181.07658 132.8
[M+HCOO]- 243.07752 164.0
[M+CH3COO]- 257.09317 153.2
[M+Na-2H]- 219.05399 147.2
[M]+ 198.07877 139.2
[M]- 198.07987 139.2
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

patents stripe