CID 10999153

Mukonidine

Structural Information

Molecular Formula

C₁₄H₁₁NO₃

SMILES

COC(=O)C1=C(C=C2C(=C1)C3=CC=CC=C3N2)O

InChI

InChI=1S/C14H11NO3/c1-18-14(17)10-6-9-8-4-2-3-5-11(8)15-12(9)7-13(10)16/h2-7,15-16H,1H3

InChIKey

SJVKEEPWQLIYIJ-UHFFFAOYSA-N

Compound name

methyl 2-hydroxy-9H-carbazole-3-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 8
Patents: 241.0739 Da
Monoisotopic Mass: 3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	242.08118	150.9
[M+Na]+	264.06312	161.6
[M-H]-	240.06662	153.6
[M+NH4]+	259.10772	170.1
[M+K]+	280.03706	156.7
[M+H-H2O]+	224.07116	144.9
[M+HCOO]-	286.07210	171.2
[M+CH3COO]-	300.08775	163.8
[M+Na-2H]-	262.04857	156.9
[M]+	241.07335	153.3
[M]-	241.07445	153.3

Literature stripe

literature stripe

Patent stripe

patents stripe