CID 39748

50634-93-0

Structural Information

Molecular Formula
C19H23NO2
SMILES
COC1=CC=CC2=C1OC(C2)CNCCCC3=CC=CC=C3
InChI
InChI=1S/C19H23NO2/c1-21-18-11-5-10-16-13-17(22-19(16)18)14-20-12-6-9-15-7-3-2-4-8-15/h2-5,7-8,10-11,17,20H,6,9,12-14H2,1H3
InChIKey
ZDWGYTYXGMPQIU-UHFFFAOYSA-N
Compound name
N-[(7-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]-3-phenylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

297.17288 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.180156 170.7
[M+Na]+ 320.162098 176.5
[M-H]- 296.165604 178.3
[M+NH4]+ 315.206703 187.1
[M+K]+ 336.136038 173.0
[M+H-H2O]+ 280.170140 162.9
[M+HCOO]- 342.171081 193.1
[M+CH3COO]- 356.186731 206.0
[M+Na-2H]- 318.147546 175.3
[M]+ 297.17233142 173.2
[M]- 297.17342858 173.2
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