CID 84051782

2137690-77-6

Structural Information

Molecular Formula
C10H12ClNO
SMILES
CC(C1=CC(=CC2=C1OCC2)Cl)N
InChI
InChI=1S/C10H12ClNO/c1-6(12)9-5-8(11)4-7-2-3-13-10(7)9/h4-6H,2-3,12H2,1H3
InChIKey
KSYXYUVBXXHRHM-UHFFFAOYSA-N
Compound name
1-(5-chloro-2,3-dihydro-1-benzofuran-7-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.06075 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.06803 139.6
[M+Na]+ 220.04997 152.0
[M+NH4]+ 215.09457 149.4
[M+K]+ 236.02391 147.4
[M-H]- 196.05347 143.8
[M+Na-2H]- 218.03542 144.4
[M]+ 197.06020 142.8
[M]- 197.06130 142.8
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

No patent data available for this compound.