CID 47646

65492-85-5

Structural Information

Molecular Formula
C15H23NO2
SMILES
CC1C2=CC(=C(C=C2CCN1C(C)C)OC)OC
InChI
InChI=1S/C15H23NO2/c1-10(2)16-7-6-12-8-14(17-4)15(18-5)9-13(12)11(16)3/h8-11H,6-7H2,1-5H3
InChIKey
XYZMYPVDTLUISQ-UHFFFAOYSA-N
Compound name
6,7-dimethoxy-1-methyl-2-propan-2-yl-3,4-dihydro-1H-isoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.17288 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.180156 159.0
[M+Na]+ 272.162098 166.6
[M-H]- 248.165604 162.1
[M+NH4]+ 267.206703 176.8
[M+K]+ 288.136038 164.4
[M+H-H2O]+ 232.170140 152.0
[M+HCOO]- 294.171081 176.6
[M+CH3COO]- 308.186731 199.7
[M+Na-2H]- 270.147546 161.3
[M]+ 249.17233142 161.3
[M]- 249.17342858 161.3
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.