CID 53971645

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

Structural Information

Molecular Formula
C10H13NO
SMILES
CC(C1COC2=CC=CC=C12)N
InChI
InChI=1S/C10H13NO/c1-7(11)9-6-12-10-5-3-2-4-8(9)10/h2-5,7,9H,6,11H2,1H3
InChIKey
JSAWVKCPAYDQPL-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1-benzofuran-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

163.09972 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.106996 134.4
[M+Na]+ 186.088938 141.6
[M-H]- 162.092444 139.1
[M+NH4]+ 181.133543 156.2
[M+K]+ 202.062878 140.5
[M+H-H2O]+ 146.096980 129.1
[M+HCOO]- 208.097921 156.6
[M+CH3COO]- 222.113571 180.1
[M+Na-2H]- 184.074386 140.1
[M]+ 163.09917142 132.8
[M]- 163.10026858 132.8
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

patents stripe