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]+ 284.16451 168.2
[M+Na]+ 306.14645 177.6
[M-H]- 282.14995 173.5
[M+NH4]+ 301.19105 185.8
[M+K]+ 322.12039 174.8
[M+H-H2O]+ 266.15449 161.1
[M+HCOO]- 328.15543 187.7
[M+CH3COO]- 342.17108 204.9
[M+Na-2H]- 304.13190 172.0
[M]+ 283.15668 174.8
[M]- 283.15778 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.