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2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-1-(4-fluorophenyl)pyrrole
SpectraBase Compound ID CVrWTCATDZq
InChI InChI=1S/C16H12FNO2S/c17-11-3-5-12(6-4-11)18-7-1-2-13(18)16-15-14(10-21-16)19-8-9-20-15/h1-7,10H,8-9H2
InChIKey YJXLXVIHWWOUDA-UHFFFAOYSA-N
Mol Weight 301.34 g/mol
Molecular Formula C16H12FNO2S
Exact Mass 301.057278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4J90cI4ZmK
Name 2-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-1-(4-fluorophenyl)pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12FNO2S
InChI InChI=1S/C16H12FNO2S/c17-11-3-5-12(6-4-11)18-7-1-2-13(18)16-15-14(10-21-16)19-8-9-20-15/h1-7,10H,8-9H2
InChIKey YJXLXVIHWWOUDA-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 301.335 g/mol
Reported Formula C16H12FNO2S
SMILES c1sc(-c2ccc[n]2-c2ccc(F)cc2)c2c1OCCO2
SPLASH splash10-0udi-0009000000-93be6391e545f9647cb6
Source of Spectrum WO2010007648A1
Wiley ID 1842735