CID 13157296

Brn 5757694

Structural Information

Molecular Formula
C20H25NO3
SMILES
CCCCCOC(C)C1=CC2=C(N=C3C=CC(=CC3=C2O1)OC)C
InChI
InChI=1S/C20H25NO3/c1-5-6-7-10-23-14(3)19-12-16-13(2)21-18-9-8-15(22-4)11-17(18)20(16)24-19/h8-9,11-12,14H,5-7,10H2,1-4H3
InChIKey
KQQMQNWXTZVXMA-UHFFFAOYSA-N
Compound name
8-methoxy-4-methyl-2-(1-pentoxyethyl)furo[3,2-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.18344 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.19072 180.8
[M+Na]+ 350.17266 190.2
[M-H]- 326.17616 185.9
[M+NH4]+ 345.21726 196.8
[M+K]+ 366.14660 187.2
[M+H-H2O]+ 310.18070 173.1
[M+HCOO]- 372.18164 200.6
[M+CH3COO]- 386.19729 213.2
[M+Na-2H]- 348.15811 183.9
[M]+ 327.18289 190.4
[M]- 327.18399 190.4
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.