CID 4203893

1-(5-chloro-1-benzofuran-2-yl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H10ClNO
SMILES
CC(C1=CC2=C(O1)C=CC(=C2)Cl)N
InChI
InChI=1S/C10H10ClNO/c1-6(12)10-5-7-4-8(11)2-3-9(7)13-10/h2-6H,12H2,1H3
InChIKey
IMSCAUVOIHGEFA-UHFFFAOYSA-N
Compound name
1-(5-chloro-1-benzofuran-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

195.04509 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.05237 137.4
[M+Na]+ 218.03431 151.7
[M+NH4]+ 213.07891 147.4
[M+K]+ 234.00825 146.7
[M-H]- 194.03781 142.1
[M+Na-2H]- 216.01976 144.0
[M]+ 195.04454 141.2
[M]- 195.04564 141.2
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