Camalexin

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Systematic / IUPAC Name: 2-(1H-Indol-3-yl)-1,3-thiazole

ID: Reference11300

Other Names: (2Z)-2-Indol-3-ylidene-3H-1,3-thiazole;
1H-Indole, 3-(2-thiazolyl)-;
2-(3-Indolyl)thiazole;
3-(1,3-Thiazol-2-yl)-1H-indole;
3-(2-Thiazolyl)indole ; more

Formula: C11H8N2S

Spectral Data

Camalexin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 145
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/24/2022 1:38:47 PM
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Identificators

InChI InChI=1S/C11H8N2S/c1-2-4-10-8(3-1)9(7-13-10)11-12-5-6-14-11/h1-7,13H
InChI Key IYODIJVWGPRBGQ-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C(=CN2)C3=NC=CS3
CAS
Splash
Other Names (2Z)-2-Indol-3-ylidene-3H-1,3-thiazole;
1H-Indole, 3-(2-thiazolyl)-;
2-(3-Indolyl)thiazole;
3-(1,3-Thiazol-2-yl)-1H-indole;
3-(2-Thiazolyl)indole;
3-(Thiazol-2-yl)-1H-indole;
3-Thiazol-2'-yl-indole;
86_KAM

In Other Databases

HMDb HMDB0038631
ChEMBL CHEMBL239716; T102147
Wikipedia Camalexin
PubChem 636970; 636970
ChEBI CHEBI:22990
KEGG C21721
ChemSpider 552646