CID 2795182

Benzofuran-5-ylmethanamine hydrochloride

Structural Information

Molecular Formula
C9H9NO
SMILES
C1=CC2=C(C=CO2)C=C1CN
InChI
InChI=1S/C9H9NO/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5H,6,10H2
InChIKey
OFMIMSPBHXZKRI-UHFFFAOYSA-N
Compound name
1-benzofuran-5-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

208
Patents

147.06842 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.07570 126.3
[M+Na]+ 170.05764 139.9
[M+NH4]+ 165.10224 136.3
[M+K]+ 186.03158 135.1
[M-H]- 146.06114 131.1
[M+Na-2H]- 168.04309 133.7
[M]+ 147.06787 129.6
[M]- 147.06897 129.6
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