CID 457723

6-methoxyonychine

Structural Information

Molecular Formula
C14H11NO2
SMILES
CC1=C2C(=NC=C1)C3=C(C2=O)C=CC(=C3)OC
InChI
InChI=1S/C14H11NO2/c1-8-5-6-15-13-11-7-9(17-2)3-4-10(11)14(16)12(8)13/h3-7H,1-2H3
InChIKey
FXQOMUALCSLULJ-UHFFFAOYSA-N
Compound name
8-methoxy-4-methylindeno[1,2-b]pyridin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

225.07898 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.08626 147.5
[M+Na]+ 248.06820 159.4
[M-H]- 224.07170 152.8
[M+NH4]+ 243.11280 169.1
[M+K]+ 264.04214 155.3
[M+H-H2O]+ 208.07624 141.2
[M+HCOO]- 270.07718 170.2
[M+CH3COO]- 284.09283 161.9
[M+Na-2H]- 246.05365 153.8
[M]+ 225.07843 151.7
[M]- 225.07953 151.7
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.