CID 13332617

Ns00116622

Structural Information

Molecular Formula
C18H15NO2
SMILES
CC1=C2C=CC3=CC=CC=C3C2=NC4=C1C(C(C=C4)O)O
InChI
InChI=1S/C18H15NO2/c1-10-12-7-6-11-4-2-3-5-13(11)17(12)19-14-8-9-15(20)18(21)16(10)14/h2-9,15,18,20-21H,1H3
InChIKey
PIMRBXVJGSKTOZ-UHFFFAOYSA-N
Compound name
7-methyl-8,9-dihydronaphtho[1,2-b]quinoline-8,9-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1103 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.11758 162.1
[M+Na]+ 300.09952 173.1
[M-H]- 276.10302 165.4
[M+NH4]+ 295.14412 179.2
[M+K]+ 316.07346 166.4
[M+H-H2O]+ 260.10756 154.2
[M+HCOO]- 322.10850 178.7
[M+CH3COO]- 336.12415 173.7
[M+Na-2H]- 298.08497 170.3
[M]+ 277.10975 162.9
[M]- 277.11085 162.9
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

No patent data available for this compound.