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]+ 300.15941 171.2
[M+Na]+ 322.14135 181.2
[M-H]- 298.14485 176.9
[M+NH4]+ 317.18595 188.3
[M+K]+ 338.11529 179.2
[M+H-H2O]+ 282.14939 164.1
[M+HCOO]- 344.15033 190.8
[M+CH3COO]- 358.16598 208.2
[M+Na-2H]- 320.12680 174.4
[M]+ 299.15158 179.6
[M]- 299.15268 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.