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(3aR,6ac)-Dihydro-4H-cyclopenta[b]furan-3-carboxylic acid (2S,3R,4S)-4-methyl-5-oxo-3-phenylsulfanyl-tetrahydrofuran-2-yl ester

View entire compound with spectra: 1 MS (GC)

(3aR,6ac)-Dihydro-4H-cyclopenta[b]furan-3-carboxylic acid (2S,3R,4S)-4-methyl-5-oxo-3-phenylsulfanyl-tetrahydrofuran-2-yl ester
SpectraBase Compound ID Jq8pH9FNtL
InChI InChI=1S/C19H18O5S/c1-11-16(25-12-6-3-2-4-7-12)19(23-17(11)20)24-18(21)14-10-22-15-9-5-8-13(14)15/h2-7,9-11,13,15-16,19H,8H2,1H3/t11-,13-,15-,16-,19+/m1/s1
InChIKey WRPDICLUVQOARE-WXIDQOIMSA-N
Mol Weight 358.41 g/mol
Molecular Formula C19H18O5S
Exact Mass 358.087495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOTAWbQ1jdh
Name (3aR,6ac)-Dihydro-4H-cyclopenta[b]furan-3-carboxylic acid (2S,3R,4S)-4-methyl-5-oxo-3-phenylsulfanyl-tetrahydrofuran-2-yl ester
Alternate Name(s) (2S,3R,4S)-4-methyl-5-oxo-3-(phenylsulfanyl)tetrahydro-2-furanyl (3aR,6aR)-4,6a-dihydro-3aH-cyclopenta[b]furan-3-carboxylate (3aR,6ac)-Dihydro-4H-cyclopenta[b]furan-3-carboxylic acid (2R,3R,4R)-4-methyl-5-oxo-3-phenylsulfanyl-tetrahydrofuran-2-yl ester (3aR,6aR)-4,6a-Dihydro-3aH-cyclopenta[b]furan-3-carboxylic acid (2S,3R,4S)-4-methyl-5-oxo-3-phenylsulfanyl-tetrahydro-furan-2-yl ester
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Formula C19H18O5S
InChI InChI=1S/C19H18O5S/c1-11-16(25-12-6-3-2-4-7-12)19(23-17(11)20)24-18(21)14-10-22-15-9-5-8-13(14)15/h2-7,9-11,13,15-16,19H,8H2,1H3/t11-,13-,15-,16-,19+/m1/s1
InChIKey WRPDICLUVQOARE-WXIDQOIMSA-N
Molecular Weight 358.408 g/mol
SMILES C1(C(O[C@@]2(OC(=O)[C@@]([C@]2(Sc2ccccc2)[H])(C)[H])[H])=O)=CO[C@]2([C@@]1(CC=C2)[H])[H]
SPLASH splash10-0a70-2940000000-eb56112dd1d7151495a0
Source of Spectrum F-54-3432-23
Wiley ID 806478