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2-(3-Carbopropoxyphenyl)-1,3-dithiane
SpectraBase Compound ID EqkZpfiA9x6
InChI InChI=1S/C14H18O2S2/c1-2-7-16-13(15)11-5-3-6-12(10-11)14-17-8-4-9-18-14/h3,5-6,10,14H,2,4,7-9H2,1H3
InChIKey LXGKWNXNEAWUFN-UHFFFAOYSA-N
Mol Weight 282.42 g/mol
Molecular Formula C14H18O2S2
Exact Mass 282.074822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91iW6yd7fdg
Name 2-(3-Carbopropoxyphenyl)-1,3-dithiane
Alternate Name(s) Propyl 3-(1,3-dithian-2-yl)benzoate
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Formula C14H18O2S2
InChI InChI=1S/C14H18O2S2/c1-2-7-16-13(15)11-5-3-6-12(10-11)14-17-8-4-9-18-14/h3,5-6,10,14H,2,4,7-9H2,1H3
InChIKey LXGKWNXNEAWUFN-UHFFFAOYSA-N
Molecular Weight 282.416 g/mol
SMILES C1(c2cc(C(=O)OCCC)ccc2)SCCCS1
SPLASH splash10-060s-4980000000-187ef023010b88897123
Source of Spectrum QB-13-446-0
Wiley ID 840994