CID 13157281

Brn 5753425

Structural Information

Molecular Formula
C18H21NO2
SMILES
CC1=NC2=CC=CC=C2C3=C1C=C(O3)C(C)OCC(C)C
InChI
InChI=1S/C18H21NO2/c1-11(2)10-20-13(4)17-9-15-12(3)19-16-8-6-5-7-14(16)18(15)21-17/h5-9,11,13H,10H2,1-4H3
InChIKey
MVWKWMZXRCSRQC-UHFFFAOYSA-N
Compound name
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

283.15723 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.164506 168.2
[M+Na]+ 306.146448 177.6
[M-H]- 282.149954 173.5
[M+NH4]+ 301.191053 185.8
[M+K]+ 322.120388 174.8
[M+H-H2O]+ 266.154490 161.1
[M+HCOO]- 328.155431 187.7
[M+CH3COO]- 342.171081 204.9
[M+Na-2H]- 304.131896 172.0
[M]+ 283.15668142 174.8
[M]- 283.15777858 174.8
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.