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2-(3'-Thienyl)-8-allylbenzopyran-4-one
SpectraBase Compound ID KITmNd409qH
InChI InChI=1S/C16H12O2S/c1-2-4-11-5-3-6-13-14(17)9-15(18-16(11)13)12-7-8-19-10-12/h2-3,5-10H,1,4H2
InChIKey MTNFUNHJJHXNTD-UHFFFAOYSA-N
Mol Weight 268.33 g/mol
Molecular Formula C16H12O2S
Exact Mass 268.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXqVgzisUp1
Name 2-(3'-Thienyl)-8-allylbenzopyran-4-one
Alternate Name(s) 8-Allyl-2-(3-thienyl)-4H-chromen-4-one 8-Allyl-2-(thiophen-3-yl)-4H-chromen-4-one
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Formula C16H12O2S
InChI InChI=1S/C16H12O2S/c1-2-4-11-5-3-6-13-14(17)9-15(18-16(11)13)12-7-8-19-10-12/h2-3,5-10H,1,4H2
InChIKey MTNFUNHJJHXNTD-UHFFFAOYSA-N
Molecular Weight 268.330 g/mol
SMILES C=1(Oc2c(CC=C)cccc2C(C1)=O)c1cscc1
SPLASH splash10-014i-0290000000-a274ed7dc2989412b76d
Source of Spectrum D8-331-407-7
Wiley ID 1516596