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(E)-1,1,1-trifluoro-4-(1H-indol-3-yl)-but-3-en-2-one

View entire compound with spectra: 3 NMR, and 1 FTIR

(E)-1,1,1-trifluoro-4-(1H-indol-3-yl)-but-3-en-2-one
SpectraBase Compound ID 2EWOYgHglOs
InChI InChI=1S/C12H8F3NO/c13-12(14,15)11(17)6-5-8-7-16-10-4-2-1-3-9(8)10/h1-7,16H/b6-5+
InChIKey NVKOBNNCHGLNGA-AATRIKPKSA-N
Mol Weight 239.2 g/mol
Molecular Formula C12H8F3NO
Exact Mass 239.055798 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ula7A3WsNE
Name trans-1,1,1-Trifluoro-4-(3-indolyl)-3-buten-2-one
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 422282
CAS Registry Number 153532-01-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8F3NO
InChI InChI=1S/C12H8F3NO/c13-12(14,15)11(17)6-5-8-7-16-10-4-2-1-3-9(8)10/h1-7,16H/b6-5+
InChIKey NVKOBNNCHGLNGA-AATRIKPKSA-N
Observed nucleus 13C
Purity 99%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (E)-1,1,1-trifluoro-4-(1H-indol-3-yl)-but-3-en-2-one (E)-1,1,1-trifluoro-4-(1H-indol-3-yl)-3-buten-2-one
Wiley ID SIAL_13CNMR_009364