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[(2S,3S)-3-[3-(dioxidanyl)-3-(4-methylphenyl)butyl]oxiran-2-yl]methyl ethanoate
SpectraBase Compound ID Lq9IwBli6Qv
InChI InChI=1S/C16H22O5/c1-11-4-6-13(7-5-11)16(3,21-18)9-8-14-15(20-14)10-19-12(2)17/h4-7,14-15,18H,8-10H2,1-3H3/t14-,15-,16?/m0/s1
InChIKey UNOFHWOWYZRHRD-KSCSMHSMSA-N
Mol Weight 294.35 g/mol
Molecular Formula C16H22O5
Exact Mass 294.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9K1e24y48E
Name [(2S,3S)-3-[3-(dioxidanyl)-3-(4-methylphenyl)butyl]oxiran-2-yl]methyl ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O5
InChI InChI=1S/C16H22O5/c1-11-4-6-13(7-5-11)16(3,21-18)9-8-14-15(20-14)10-19-12(2)17/h4-7,14-15,18H,8-10H2,1-3H3/t14-,15-,16?/m0/s1
InChIKey UNOFHWOWYZRHRD-KSCSMHSMSA-N
Molecular Weight 294.347 g/mol
SMILES OOC(CC[C@@]1(O[C@]1(COC(=O)C)[H])[H])(c1ccc(cc1)C)C
SPLASH splash10-0wml-3790000000-dc55dff6bdff683cdde7
Source of Spectrum J-60-3043-14
Synonyms [(2S,3S)-3-[3-hydroperoxy-3-(4-methylphenyl)butyl]oxiran-2-yl]methyl acetate [(2S,3S)-3-[3-hydroperoxy-3-(p-tolyl)butyl]oxiran-2-yl]methyl acetate Acetic acid [(2S,3S)-3-[3-hydroperoxy-3-(4-methylphenyl)butyl]-2-oxiranyl]methyl ester
Wiley ID 1297157