CID 13157283

Brn 5754490

Structural Information

Molecular Formula
C19H23NO2
SMILES
CC1=NC2=CC=CC=C2C3=C1C=C(O3)C(C)OCCC(C)C
InChI
InChI=1S/C19H23NO2/c1-12(2)9-10-21-14(4)18-11-16-13(3)20-17-8-6-5-7-15(17)19(16)22-18/h5-8,11-12,14H,9-10H2,1-4H3
InChIKey
QYZPVGGEIBTJFM-UHFFFAOYSA-N
Compound name
4-methyl-2-[1-(3-methylbutoxy)ethyl]furo[3,2-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.17288 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.18016 173.1
[M+Na]+ 320.16210 182.0
[M-H]- 296.16560 178.2
[M+NH4]+ 315.20670 190.1
[M+K]+ 336.13604 179.0
[M+H-H2O]+ 280.17014 165.7
[M+HCOO]- 342.17108 192.2
[M+CH3COO]- 356.18673 207.9
[M+Na-2H]- 318.14755 176.3
[M]+ 297.17233 180.0
[M]- 297.17343 180.0
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.