CID 115076406

2230802-85-2

Structural Information

Molecular Formula
C14H19NO2
SMILES
C1COCC1COC2=CC3=C(CNCC3)C=C2
InChI
InChI=1S/C14H19NO2/c1-2-14(17-10-11-4-6-16-9-11)7-12-3-5-15-8-13(1)12/h1-2,7,11,15H,3-6,8-10H2
InChIKey
GRAGSIQJYQHDFD-UHFFFAOYSA-N
Compound name
6-(oxolan-3-ylmethoxy)-1,2,3,4-tetrahydroisoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.14159 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.14887 154.3
[M+Na]+ 256.13081 165.6
[M+NH4]+ 251.17541 163.4
[M+K]+ 272.10475 160.6
[M-H]- 232.13431 158.9
[M+Na-2H]- 254.11626 159.2
[M]+ 233.14104 157.1
[M]- 233.14214 157.1
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.