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(2S,3S,4S)-6-(Hexanoylamino)-2,3-epoxy-4-hydroxycyclohex-5-enone
SpectraBase Compound ID 3zSBzYgixQq
InChI InChI=1S/C12H17NO4/c1-2-3-4-5-9(15)13-7-6-8(14)11-12(17-11)10(7)16/h6,8,11-12,14H,2-5H2,1H3,(H,13,15)/t8-,11-,12+/m0/s1
InChIKey SGYBLAXSHAWDRO-KPXOXKRLSA-N
Mol Weight 239.27 g/mol
Molecular Formula C12H17NO4
Exact Mass 239.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AG01WgWhgOO
Name (2S,3S,4S)-6-(Hexanoylamino)-2,3-epoxy-4-hydroxycyclohex-5-enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO4
InChI InChI=1S/C12H17NO4/c1-2-3-4-5-9(15)13-7-6-8(14)11-12(17-11)10(7)16/h6,8,11-12,14H,2-5H2,1H3,(H,13,15)/t8-,11-,12+/m0/s1
InChIKey SGYBLAXSHAWDRO-KPXOXKRLSA-N
Molecular Weight 239.271 g/mol
SMILES O[C@@]1([C@]2([C@@](C(C(=C1)NC(=O)CCCCC)=O)(O2)[H])[H])[H]
SPLASH splash10-024j-8910000000-f7226eb0b1a02eb04bbc
Source of Spectrum SO-0-1558-29
Synonyms (2SR,3SR,4SR)-6-(Hexanoylamino)-2,3-epoxy-4-hydroxycyclohex-5-enone N-[(1S,5S,6S)-5-hydroxy-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hexanamide
Wiley ID 1546065