CID 29856

Benzylsalsolidine

Structural Information

Molecular Formula
C19H23NO2
SMILES
CC1C2=CC(=C(C=C2CCN1CC3=CC=CC=C3)OC)OC
InChI
InChI=1S/C19H23NO2/c1-14-17-12-19(22-3)18(21-2)11-16(17)9-10-20(14)13-15-7-5-4-6-8-15/h4-8,11-12,14H,9-10,13H2,1-3H3
InChIKey
QMFRUXSSVRREFN-UHFFFAOYSA-N
Compound name
2-benzyl-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.17288 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.18016 171.8
[M+Na]+ 320.16210 187.3
[M+NH4]+ 315.20670 180.9
[M+K]+ 336.13604 178.2
[M-H]- 296.16560 177.0
[M+Na-2H]- 318.14755 179.6
[M]+ 297.17233 175.7
[M]- 297.17343 175.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.