CID 504069

Methyl 3-carbazolecarboxylate

Structural Information

Molecular Formula

C₁₄H₁₁NO₂

SMILES

COC(=O)C1=CC2=C(C=C1)NC3=CC=CC=C32

InChI

InChI=1S/C14H11NO2/c1-17-14(16)9-6-7-13-11(8-9)10-4-2-3-5-12(10)15-13/h2-8,15H,1H3

InChIKey

LZXXHWWSVRIDGR-UHFFFAOYSA-N

Compound name

methyl 9H-carbazole-3-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 11
References: 73
Patents: 225.07898 Da
Monoisotopic Mass: 3.6
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]+	226.08626	147.8
[M+Na]+	248.06820	162.4
[M+NH4]+	243.11280	156.9
[M+K]+	264.04214	156.8
[M-H]-	224.07170	150.0
[M+Na-2H]-	246.05365	154.3
[M]+	225.07843	150.5
[M]-	225.07953	150.5

Literature stripe

literature stripe

Patent stripe

patents stripe