CID 15934551

2-(7-methoxy-2-methyl-1-benzofuran-4-yl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C12H15NO2
SMILES
CC1=CC2=C(C=CC(=C2O1)OC)CCN
InChI
InChI=1S/C12H15NO2/c1-8-7-10-9(5-6-13)3-4-11(14-2)12(10)15-8/h3-4,7H,5-6,13H2,1-2H3
InChIKey
PEBQFBCOEOURLG-UHFFFAOYSA-N
Compound name
2-(7-methoxy-2-methyl-1-benzofuran-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.11028 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.11756 143.6
[M+Na]+ 228.09950 154.1
[M-H]- 204.10300 149.4
[M+NH4]+ 223.14410 164.6
[M+K]+ 244.07344 152.2
[M+H-H2O]+ 188.10754 138.1
[M+HCOO]- 250.10848 169.2
[M+CH3COO]- 264.12413 189.2
[M+Na-2H]- 226.08495 150.0
[M]+ 205.10973 148.5
[M]- 205.11083 148.5
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.