3-Benzo[b]furan-2-yl-2-(tert-butylsulfonyl)acrylonitrile

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Systematic / IUPAC Name: (2E)-3-(1-Benzofuran-2-yl)-2-[(2-methyl-2-propanyl)sulfonyl]acrylonitrile

ID: Reference3605

Other Names: 2-Propenenitrile, 3-(2-benzofuranyl)-2-[(1,1-dimethylethyl)sulfonyl]-, (2E)-

Formula: C15H15NO3S

Spectral Data

3-Benzo[b]furan-2-yl-2-(tert-butylsulfonyl)acrylonitrile 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 Elite
No. of Spectral Trees 1
No. of Spectra 233
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 1/14/2016 2:06:40 PM
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Identificators

InChI InChI=1S/C15H15NO3S/c1-15(2,3)20(17,18)13(10-16)9-12-8-11-6-4-5-7-14(11)19-12/h4-9H,1-3H3/b13-9+
InChI Key JLRKGFSDQUJOOA-UKTHLTGXSA-N
Canonical SMILES CC(C)(C)S(=O)(=O)C(=CC1=CC2=CC=CC=C2O1)C#N
CAS
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Other Names 2-Propenenitrile, 3-(2-benzofuranyl)-2-[(1,1-dimethylethyl)sulfonyl]-, (2E)-

In Other Databases

PubChem 5703127
ChemSpider 4643323