CID 10241606

Quinoline, 1-butyl-1,2,3,4-tetrahydro-

Structural Information

Molecular Formula
C13H19N
SMILES
CCCCN1CCCC2=CC=CC=C21
InChI
InChI=1S/C13H19N/c1-2-3-10-14-11-6-8-12-7-4-5-9-13(12)14/h4-5,7,9H,2-3,6,8,10-11H2,1H3
InChIKey
HIWBVBCKPRGRCD-UHFFFAOYSA-N
Compound name
1-butyl-3,4-dihydro-2H-quinoline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

40
Patents

189.15175 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 143.8
[M+Na]+ 212.14097 149.8
[M-H]- 188.14447 146.0
[M+NH4]+ 207.18557 163.2
[M+K]+ 228.11491 146.4
[M+H-H2O]+ 172.14901 136.6
[M+HCOO]- 234.14995 162.8
[M+CH3COO]- 248.16560 185.3
[M+Na-2H]- 210.12642 150.4
[M]+ 189.15120 141.8
[M]- 189.15230 141.8
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

patents stripe