CID 3055556

2-benzofurancarboximidamide

Structural Information

Molecular Formula
C9H8N2O
SMILES
C1=CC=C2C(=C1)C=C(O2)C(=N)N
InChI
InChI=1S/C9H8N2O/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h1-5H,(H3,10,11)
InChIKey
PDECXGQFPNZGGZ-UHFFFAOYSA-N
Compound name
1-benzofuran-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

66
Patents

160.06366 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.07094 129.8
[M+Na]+ 183.05288 138.9
[M-H]- 159.05638 135.4
[M+NH4]+ 178.09748 151.4
[M+K]+ 199.02682 137.0
[M+H-H2O]+ 143.06092 124.2
[M+HCOO]- 205.06186 156.4
[M+CH3COO]- 219.07751 180.7
[M+Na-2H]- 181.03833 138.4
[M]+ 160.06311 129.4
[M]- 160.06421 129.4
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