CID 12751752

2-(1,3-dihydro-2-benzofuran-5-yl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H13NO
SMILES
C1C2=C(CO1)C=C(C=C2)CCN
InChI
InChI=1S/C10H13NO/c11-4-3-8-1-2-9-6-12-7-10(9)5-8/h1-2,5H,3-4,6-7,11H2
InChIKey
ITZAREVHWOKQBH-UHFFFAOYSA-N
Compound name
2-(1,3-dihydro-2-benzofuran-5-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

163.09972 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.106996 133.3
[M+Na]+ 186.088938 140.9
[M-H]- 162.092444 138.0
[M+NH4]+ 181.133543 155.2
[M+K]+ 202.062878 139.3
[M+H-H2O]+ 146.096980 127.9
[M+HCOO]- 208.097921 156.6
[M+CH3COO]- 222.113571 179.3
[M+Na-2H]- 184.074386 140.3
[M]+ 163.09917142 132.4
[M]- 163.10026858 132.4
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