CID 3072610

143436-46-8

Structural Information

Molecular Formula
C17H22NO4
SMILES
CC(C)(C1CC2=C(C3=C(C(=CC=C3)OC)[N+](=C2O1)C)OC)O
InChI
InChI=1S/C17H22NO4/c1-17(2,19)13-9-11-15(21-5)10-7-6-8-12(20-4)14(10)18(3)16(11)22-13/h6-8,13,19H,9H2,1-5H3/q+1
InChIKey
OQZCPLGYHZLFBM-UHFFFAOYSA-N
Compound name
2-(4,8-dimethoxy-9-methyl-2,3-dihydrofuro[2,3-b]quinolin-9-ium-2-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.15488 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.16216 167.6
[M+Na]+ 327.14410 182.2
[M+NH4]+ 322.18870 176.2
[M+K]+ 343.11804 179.6
[M-H]- 303.14760 171.4
[M+Na-2H]- 325.12955 171.1
[M]+ 304.15433 171.2
[M]- 304.15543 171.2
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

No patent data available for this compound.