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

0
Patents

297.17288 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.18016 170.7
[M+Na]+ 320.16210 176.5
[M-H]- 296.16560 178.3
[M+NH4]+ 315.20670 187.1
[M+K]+ 336.13604 173.0
[M+H-H2O]+ 280.17014 162.9
[M+HCOO]- 342.17108 193.1
[M+CH3COO]- 356.18673 206.0
[M+Na-2H]- 318.14755 175.3
[M]+ 297.17233 173.2
[M]- 297.17343 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