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(2R)-2-[(R)-methoxysulfonyl(phenyl)methyl]pentanoic acid ethyl ester
SpectraBase Compound ID 6vII2IhBkPr
InChI InChI=1S/C15H22O5S/c1-4-9-13(15(16)20-5-2)14(21(17,18)19-3)12-10-7-6-8-11-12/h6-8,10-11,13-14H,4-5,9H2,1-3H3/t13-,14-/m0/s1
InChIKey ALXXYEOISRPVGC-KBPBESRZSA-N
Mol Weight 314.4 g/mol
Molecular Formula C15H22O5S
Exact Mass 314.118795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgMLxUXNyjx
Name (2R)-2-[(R)-methoxysulfonyl(phenyl)methyl]pentanoic acid ethyl ester
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Formula C15H22O5S
InChI InChI=1S/C15H22O5S/c1-4-9-13(15(16)20-5-2)14(21(17,18)19-3)12-10-7-6-8-11-12/h6-8,10-11,13-14H,4-5,9H2,1-3H3/t13-,14-/m0/s1
InChIKey ALXXYEOISRPVGC-KBPBESRZSA-N
Molecular Weight 314.396 g/mol
SMILES [C@](S(=O)(=O)OC)([C@@](C(=O)OCC)(CCC)[H])(c1ccccc1)[H]
SPLASH splash10-014v-2930000000-d2850502519dc4c706c6
Source of Spectrum C5-2002-1951-6
Synonyms (2R)-2-[(R)-methoxysulfonyl(phenyl)methyl]valeric acid ethyl ester
Wiley ID 1615088