CID 13157284

Brn 5754243

Structural Information

Molecular Formula
C18H21NO3
SMILES
CC1=C2C=C(OC2=C3C=CC=C(C3=N1)OC)C(C)OC(C)C
InChI
InChI=1S/C18H21NO3/c1-10(2)21-12(4)16-9-14-11(3)19-17-13(18(14)22-16)7-6-8-15(17)20-5/h6-10,12H,1-5H3
InChIKey
KPEUZNJHYLKSAR-UHFFFAOYSA-N
Compound name
6-methoxy-4-methyl-2-(1-propan-2-yloxyethyl)furo[3,2-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.15213 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.159406 171.2
[M+Na]+ 322.141348 181.2
[M-H]- 298.144854 176.9
[M+NH4]+ 317.185953 188.3
[M+K]+ 338.115288 179.2
[M+H-H2O]+ 282.149390 164.1
[M+HCOO]- 344.150331 190.8
[M+CH3COO]- 358.165981 208.2
[M+Na-2H]- 320.126796 174.4
[M]+ 299.15158142 179.6
[M]- 299.15267858 179.6
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.