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(1R,3S)-3-(2,2-dithiophen-2-ylethenyl)-2,2-dimethyl-1-cyclopropanecarboxylic acid methyl ester
SpectraBase Compound ID 46UyqBASnrS
InChI InChI=1S/C17H18O2S2/c1-17(2)12(15(17)16(18)19-3)10-11(13-6-4-8-20-13)14-7-5-9-21-14/h4-10,12,15H,1-3H3/t12-,15-/m0/s1
InChIKey WUCYYCWKYCPWPP-WFASDCNBSA-N
Mol Weight 318.45 g/mol
Molecular Formula C17H18O2S2
Exact Mass 318.074822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTto1Q2IF8e
Name (1R,3S)-3-(2,2-dithiophen-2-ylethenyl)-2,2-dimethyl-1-cyclopropanecarboxylic acid methyl ester
Alternate Name(s) (1R,3S)-3-[2,2-bis(2-thienyl)vinyl]-2,2-dimethyl-cyclopropanecarboxylic acid methyl ester methyl (1R,3S)-3-(2,2-dithiophen-2-ylethenyl)-2,2-dimethyl-cyclopropane-1-carboxylate methyl (1R,3S)-3-[2,2-bis(2-thienyl)vinyl]-2,2-dimethyl-cyclopropanecarboxylate
CAS Registry Number 133472-24-9
Comments Less than 3 mono-isotopic peaks
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Formula C17H18O2S2
InChI InChI=1S/C17H18O2S2/c1-17(2)12(15(17)16(18)19-3)10-11(13-6-4-8-20-13)14-7-5-9-21-14/h4-10,12,15H,1-3H3/t12-,15-/m0/s1
InChIKey WUCYYCWKYCPWPP-WFASDCNBSA-N
Molecular Weight 318.449 g/mol
SMILES [C@@]1(C(C)(C)[C@@]1(C(=O)OC)[H])(C=C(c1sccc1)c1sccc1)[H]
SPLASH splash10-0aor-0098000000-57d45c9dff107b62b84c
Source of Spectrum J-56-4055-16
Wiley ID 1318362