CID 13157295

Brn 5756664

Structural Information

Molecular Formula
C19H23NO3
SMILES
CC1=C2C=C(OC2=C3C=C(C=CC3=N1)OC)C(C)OCC(C)C
InChI
InChI=1S/C19H23NO3/c1-11(2)10-22-13(4)18-9-15-12(3)20-17-7-6-14(21-5)8-16(17)19(15)23-18/h6-9,11,13H,10H2,1-5H3
InChIKey
UJAGXHAWXHMPBU-UHFFFAOYSA-N
Compound name
8-methoxy-4-methyl-2-[1-(2-methylpropoxy)ethyl]furo[3,2-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.1678 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.175076 176.1
[M+Na]+ 336.157018 185.7
[M-H]- 312.160524 181.5
[M+NH4]+ 331.201623 192.6
[M+K]+ 352.130958 183.4
[M+H-H2O]+ 296.165060 168.8
[M+HCOO]- 358.166001 195.3
[M+CH3COO]- 372.181651 211.2
[M+Na-2H]- 334.142466 178.7
[M]+ 313.16725142 184.8
[M]- 313.16834858 184.8
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.