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Methyl-3-((trifluoromethyl)thio)indolizine-1-carboxylate
SpectraBase Compound ID 2A6WsJfTGOk
InChI InChI=1S/C11H8F3NO2S/c1-17-10(16)7-6-9(18-11(12,13)14)15-5-3-2-4-8(7)15/h2-6H,1H3
InChIKey KFPVQAUTOKTYBS-UHFFFAOYSA-N
Mol Weight 275.25 g/mol
Molecular Formula C11H8F3NO2S
Exact Mass 275.022784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3s5GQGtOw6j
Name Methyl-3-((trifluoromethyl)thio)indolizine-1-carboxylate
Appearance Off-white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.022784163 u
Formula C11H8F3NO2S
GC Column HP-5MS (0.25 mm x 30 m, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C11H8F3NO2S/c1-17-10(16)7-6-9(18-11(12,13)14)15-5-3-2-4-8(7)15/h2-6H,1H3
InChIKey KFPVQAUTOKTYBS-UHFFFAOYSA-N
Instrument Name Agilent Technologies 7890A Agilent 5975C VL MSD or 5975 inert MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500957
Molecular Weight 275.245 g/mol
Quality 46
SMILES C1=CN2C(C=C1)=C(C=C2SC(F)(F)F)C(OC)=O
SPLASH splash10-0a4j-0490000000-0a24bbff16de7ad241a6
Source of Spectrum QE-21-SM26-26-2 (DOI: 10.1002/chem.201500957)
Thin-Layer Chromatography 0.42 (Et2O/n-Pentane, 20%)
Wiley ID 1906589