CID 484142

8-chloro-4-(1h-indol-3-yl)-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline

Structural Information

Molecular Formula
C19H17ClN2O
SMILES
C1COC2C1C(NC3=C2C=C(C=C3)Cl)C4=CNC5=CC=CC=C54
InChI
InChI=1S/C19H17ClN2O/c20-11-5-6-17-14(9-11)19-13(7-8-23-19)18(22-17)15-10-21-16-4-2-1-3-12(15)16/h1-6,9-10,13,18-19,21-22H,7-8H2
InChIKey
YAKHACPTOIOVQC-UHFFFAOYSA-N
Compound name
8-chloro-4-(1H-indol-3-yl)-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.10294 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.11022 174.1
[M+Na]+ 347.09216 184.1
[M-H]- 323.09566 179.1
[M+NH4]+ 342.13676 190.5
[M+K]+ 363.06610 176.0
[M+H-H2O]+ 307.10020 166.7
[M+HCOO]- 369.10114 183.7
[M+CH3COO]- 383.11679 184.4
[M+Na-2H]- 345.07761 175.8
[M]+ 324.10239 173.3
[M]- 324.10349 173.3
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.