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(3S,4R)-3-[2-(tert-Butyloxy)ethyl]-4-vinyl-5-pentanolide
SpectraBase Compound ID 72cPYKTh4Tm
InChI InChI=1S/C13H22O3/c1-5-10-9-15-12(14)8-11(10)6-7-16-13(2,3)4/h5,10-11H,1,6-9H2,2-4H3/t10-,11-/m0/s1
InChIKey ONVBNKZJUPLTAD-QWRGUYRKSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4N5E1AvetO5
Name (3S,4R)-3-[2-(tert-Butyloxy)ethyl]-4-vinyl-5-pentanolide
Alternate Name(s) (4S,5R)-4-(2-tert-butoxyethyl)-5-vinyltetrahydro-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-5-10-9-15-12(14)8-11(10)6-7-16-13(2,3)4/h5,10-11H,1,6-9H2,2-4H3/t10-,11-/m0/s1
InChIKey ONVBNKZJUPLTAD-QWRGUYRKSA-N
Molecular Weight 226.316 g/mol
SMILES C1(OC[C@@]([C@](C1)(CCOC(C)(C)C)[H])(C=C)[H])=O
SPLASH splash10-0c03-9730000000-9a22d8b804544748199e
Source of Spectrum F-49-1039-26
Wiley ID 1227669