CID 11217277

67830-55-1

Structural Information

Molecular Formula
C8H7NO
SMILES
C1=CC2=C(C(=C1)N)OC=C2
InChI
InChI=1S/C8H7NO/c9-7-3-1-2-6-4-5-10-8(6)7/h1-5H,9H2
InChIKey
YYWJHOJMCOIVNS-UHFFFAOYSA-N
Compound name
1-benzofuran-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

317
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

No literature data available for this compound.

Patent stripe

patents stripe