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Methyl (2R)-[(1R)-2-[(R)-2-[(R)-(p-tolylsulfinyl)]-2-cyclopentenyl]propanoate
SpectraBase Compound ID 8WuiHxU8XJU
InChI InChI=1S/C16H20O3S/c1-11-7-9-13(10-8-11)20(18)15-6-4-5-14(15)12(2)16(17)19-3/h6-10,12,14H,4-5H2,1-3H3/t12-,14-,20?/m1/s1
InChIKey NFNKDGZDNWEKPT-ODMUOTMDSA-N
Mol Weight 292.39 g/mol
Molecular Formula C16H20O3S
Exact Mass 292.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jd8cZyDEh6R
Name Methyl (2R)-[(1R)-2-[(R)-2-[(R)-(p-tolylsulfinyl)]-2-cyclopentenyl]propanoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H20O3S
InChI InChI=1S/C16H20O3S/c1-11-7-9-13(10-8-11)20(18)15-6-4-5-14(15)12(2)16(17)19-3/h6-10,12,14H,4-5H2,1-3H3/t12-,14-,20?/m1/s1
InChIKey NFNKDGZDNWEKPT-ODMUOTMDSA-N
Molecular Weight 292.393 g/mol
SMILES C=1([S@@](c2ccc(cc2)C)=O)[C@@]([C@](C(=O)OC)(C)[H])(CCC1)[H]
SPLASH splash10-0udi-0900000000-64f4cc2f5fc125c5fab3
Source of Spectrum F-69-6339-5
Wiley ID 1595666