CID 71700

Methyl-6 stibio-oxy-8 quinoleine

Structural Information

Molecular Formula
C10H9NO
SMILES
CC1=CC2=C(C(=C1)O)N=CC=C2
InChI
InChI=1S/C10H9NO/c1-7-5-8-3-2-4-11-10(8)9(12)6-7/h2-6,12H,1H3
InChIKey
AIBOXZCUYYHFTM-UHFFFAOYSA-N
Compound name
6-methylquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

137
Patents

159.06842 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.07570 130.8
[M+Na]+ 182.05764 146.2
[M+NH4]+ 177.10224 140.5
[M+K]+ 198.03158 138.7
[M-H]- 158.06114 133.7
[M+Na-2H]- 180.04309 139.0
[M]+ 159.06787 133.9
[M]- 159.06897 133.9
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

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