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]+ 164.10700 133.3
[M+Na]+ 186.08894 140.9
[M-H]- 162.09244 138.0
[M+NH4]+ 181.13354 155.2
[M+K]+ 202.06288 139.3
[M+H-H2O]+ 146.09698 127.9
[M+HCOO]- 208.09792 156.6
[M+CH3COO]- 222.11357 179.3
[M+Na-2H]- 184.07439 140.3
[M]+ 163.09917 132.4
[M]- 163.10027 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