CID 166430

73545-11-6

Structural Information

Molecular Formula
C20H29NO
SMILES
CCCCC(CC)CCC(C)C1=C(C2=C(C=CC=N2)C=C1)O
InChI
InChI=1S/C20H29NO/c1-4-6-8-16(5-2)11-10-15(3)18-13-12-17-9-7-14-21-19(17)20(18)22/h7,9,12-16,22H,4-6,8,10-11H2,1-3H3
InChIKey
YWACCMLWVBYNHR-UHFFFAOYSA-N
Compound name
7-(5-ethylnonan-2-yl)quinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

395
Patents

299.2249 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.23218 176.6
[M+Na]+ 322.21412 189.1
[M+NH4]+ 317.25872 184.3
[M+K]+ 338.18806 180.9
[M-H]- 298.21762 178.7
[M+Na-2H]- 320.19957 181.3
[M]+ 299.22435 179.0
[M]- 299.22545 179.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe