CID 19959504

1-benzofuran-6-amine hydrochloride

Structural Information

Molecular Formula
C8H7NO
SMILES
C1=CC(=CC2=C1C=CO2)N
InChI
InChI=1S/C8H7NO/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5H,9H2
InChIKey
ARNCZJZLEMLOBH-UHFFFAOYSA-N
Compound name
1-benzofuran-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

161
Patents

133.05276 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.060036 121.0
[M+Na]+ 156.041978 131.6
[M-H]- 132.045484 126.8
[M+NH4]+ 151.086583 144.4
[M+K]+ 172.015918 130.1
[M+H-H2O]+ 116.050020 116.1
[M+HCOO]- 178.050961 147.9
[M+CH3COO]- 192.066611 137.0
[M+Na-2H]- 154.027426 131.1
[M]+ 133.05221142 122.4
[M]- 133.05330858 122.4
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