CID 3039501

1h-cyclopenta(b)quinoline, 2,3-dihydro-5-chloro-9-(4-morpholinyl)-, hydrochloride

Structural Information

Molecular Formula
C16H17ClN2O
SMILES
C1CC2=C(C3=C(C(=CC=C3)Cl)N=C2C1)N4CCOCC4
InChI
InChI=1S/C16H17ClN2O/c17-13-5-1-4-12-15(13)18-14-6-2-3-11(14)16(12)19-7-9-20-10-8-19/h1,4-5H,2-3,6-10H2
InChIKey
XALCBSXIEWMGAA-UHFFFAOYSA-N
Compound name
4-(5-chloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.10294 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.110216 166.2
[M+Na]+ 311.092158 174.2
[M-H]- 287.095664 171.5
[M+NH4]+ 306.136763 182.2
[M+K]+ 327.066098 168.8
[M+H-H2O]+ 271.100200 157.3
[M+HCOO]- 333.101141 176.2
[M+CH3COO]- 347.116791 176.7
[M+Na-2H]- 309.077606 169.4
[M]+ 288.10239142 164.6
[M]- 288.10348858 164.6
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.