2-[4-(5-Methyl-3-phenylisoxazol-4-yl)-1,3-thiazol-2-yl]acetonitrile

Systematic / IUPAC Name: [4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]acetonitrile

ID: Reference3724

Other Names: 2-Thiazoleacetonitrile, 4-(5-methyl-3-phenyl-4-isoxazolyl)-

Formula: C15H11N3OS

Spectral Data

2-[4-(5-Methyl-3-phenylisoxazol-4-yl)-1,3-thiazol-2-yl]acetonitrile 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 Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/5/2016 12:07:56 PM
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Identificators

InChI InChI=1S/C15H11N3OS/c1-10-14(12-9-20-13(17-12)7-8-16)15(18-19-10)11-5-3-2-4-6-11/h2-6,9H,7H2,1H3
InChI Key ULSMJXVTOYPUOH-UHFFFAOYSA-N
Canonical SMILES CC1=C(C(=NO1)C2=CC=CC=C2)C3=CSC(=N3)CC#N
CAS
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Other Names 2-Thiazoleacetonitrile, 4-(5-methyl-3-phenyl-4-isoxazolyl)-

In Other Databases

ChemSpider 2024018
PubChem 2742487