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2-(5'-Chloro-2'-thienyl)-8-allylbenzopyran-4-one
SpectraBase Compound ID KTeUbOvutzD
InChI InChI=1S/C16H11ClO2S/c1-2-4-10-5-3-6-11-12(18)9-13(19-16(10)11)14-7-8-15(17)20-14/h2-3,5-9H,1,4H2
InChIKey BFUKFYVUTCVRIE-UHFFFAOYSA-N
Mol Weight 302.78 g/mol
Molecular Formula C16H11ClO2S
Exact Mass 302.016828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Lz7jAK6qbK
Name 2-(5'-Chloro-2'-thienyl)-8-allylbenzopyran-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H11ClO2S
InChI InChI=1S/C16H11ClO2S/c1-2-4-10-5-3-6-11-12(18)9-13(19-16(10)11)14-7-8-15(17)20-14/h2-3,5-9H,1,4H2
InChIKey BFUKFYVUTCVRIE-UHFFFAOYSA-N
Molecular Weight 302.775 g/mol
SMILES C=1(Oc2c(CC=C)cccc2C(C1)=O)c1sc(Cl)cc1
SPLASH splash10-0uxr-0069000000-a73f5dda860d8aae4ccc
Source of Spectrum D8-331-407-7
Synonyms 8-allyl-2-(5-chloro-2-thienyl)-4H-chromen-4-one
Wiley ID 1516586