CID 21295

6h-cyclohepta(b)quinoline, 11-(3-(dimethylamino)propoxy)-7,8,9,10-tetrahydro-, dihydrochloride

Structural Information

Molecular Formula
C19H26N2O
SMILES
CN(C)CCCOC1=C2CCCCCC2=NC3=CC=CC=C31
InChI
InChI=1S/C19H26N2O/c1-21(2)13-8-14-22-19-15-9-4-3-5-11-17(15)20-18-12-7-6-10-16(18)19/h6-7,10,12H,3-5,8-9,11,13-14H2,1-2H3
InChIKey
LWOWZQTZJDWZOL-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yloxy)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.2045 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.211776 169.9
[M+Na]+ 321.193718 173.9
[M-H]- 297.197224 175.3
[M+NH4]+ 316.238323 185.3
[M+K]+ 337.167658 174.3
[M+H-H2O]+ 281.201760 162.4
[M+HCOO]- 343.202701 187.9
[M+CH3COO]- 357.218351 179.8
[M+Na-2H]- 319.179166 175.0
[M]+ 298.20395142 168.1
[M]- 298.20504858 168.1
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.