CID 13157287

Brn 5750718

Structural Information

Molecular Formula
C16H16ClNO2
SMILES
CCOC(C)C1=CC2=C(N=C3C(=C2O1)C=CC=C3Cl)C
InChI
InChI=1S/C16H16ClNO2/c1-4-19-10(3)14-8-12-9(2)18-15-11(16(12)20-14)6-5-7-13(15)17/h5-8,10H,4H2,1-3H3
InChIKey
ODZIIXLJSDXDAS-UHFFFAOYSA-N
Compound name
6-chloro-2-(1-ethoxyethyl)-4-methylfuro[3,2-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.08694 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.09422 165.5
[M+Na]+ 312.07616 177.8
[M-H]- 288.07966 171.2
[M+NH4]+ 307.12076 184.1
[M+K]+ 328.05010 173.4
[M+H-H2O]+ 272.08420 159.3
[M+HCOO]- 334.08514 182.0
[M+CH3COO]- 348.10079 178.8
[M+Na-2H]- 310.06161 170.3
[M]+ 289.08639 174.6
[M]- 289.08749 174.6
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.