CID 24898872

Clausine l

Structural Information

Molecular Formula

C₁₅H₁₃NO₃

SMILES

COC1=C(C=C2C3=CC=CC=C3NC2=C1)C(=O)OC

InChI

InChI=1S/C15H13NO3/c1-18-14-8-13-10(7-11(14)15(17)19-2)9-5-3-4-6-12(9)16-13/h3-8,16H,1-2H3

InChIKey

BYDOYRHWHKPKQP-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 0
Patents: 255.08954 Da
Monoisotopic Mass: 3.2
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]+	256.096816	155.5
[M+Na]+	278.078758	166.1
[M-H]-	254.082264	159.3
[M+NH4]+	273.123363	174.8
[M+K]+	294.052698	161.8
[M+H-H2O]+	238.086800	148.9
[M+HCOO]-	300.087741	176.9
[M+CH3COO]-	314.103391	168.5
[M+Na-2H]-	276.064206	161.3
[M]+	255.08899142	160.0
[M]-	255.09008858	160.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.