CID 3716675

9-ethyl-9h-carbazole-3,6-dicarbaldehyde

Structural Information

Molecular Formula

C₁₆H₁₃NO₂

SMILES

CCN1C2=C(C=C(C=C2)C=O)C3=C1C=CC(=C3)C=O

InChI

InChI=1S/C16H13NO2/c1-2-17-15-5-3-11(9-18)7-13(15)14-8-12(10-19)4-6-16(14)17/h3-10H,2H2,1H3

InChIKey

YUYGLHDPWGWFQB-UHFFFAOYSA-N

Compound name

9-ethylcarbazole-3,6-dicarbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 109
Patents: 251.09464 Da
Monoisotopic Mass: 2.6
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]+	252.10192	155.2
[M+Na]+	274.08386	167.5
[M-H]-	250.08736	160.5
[M+NH4]+	269.12846	175.7
[M+K]+	290.05780	162.0
[M+H-H2O]+	234.09190	148.4
[M+HCOO]-	296.09284	178.7
[M+CH3COO]-	310.10849	169.2
[M+Na-2H]-	272.06931	161.2
[M]+	251.09409	160.8
[M]-	251.09519	160.8

Literature stripe

literature stripe

Patent stripe

patents stripe