CID 47976

5-benzofurancarboximidamide, 2-(4-aminophenyl)-

Structural Information

Molecular Formula
C15H13N3O
SMILES
C1=CC(=CC=C1C2=CC3=C(O2)C=CC(=C3)C(=N)N)N
InChI
InChI=1S/C15H13N3O/c16-12-4-1-9(2-5-12)14-8-11-7-10(15(17)18)3-6-13(11)19-14/h1-8H,16H2,(H3,17,18)
InChIKey
JFAQOOBELVSFLA-UHFFFAOYSA-N
Compound name
2-(4-aminophenyl)-1-benzofuran-5-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

251.10587 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.113146 155.6
[M+Na]+ 274.095088 164.4
[M-H]- 250.098594 164.1
[M+NH4]+ 269.139693 173.0
[M+K]+ 290.069028 160.3
[M+H-H2O]+ 234.103130 148.3
[M+HCOO]- 296.104071 181.9
[M+CH3COO]- 310.119721 168.6
[M+Na-2H]- 272.080536 161.3
[M]+ 251.10532142 154.1
[M]- 251.10641858 154.1
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.