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(2S,3S,1'S)-1,4-Di(methoxy)-2-[.alpha.-cyclopentylbenzoyly]butan-3-ol
SpectraBase Compound ID DhE2IcksSDD
InChI InChI=1S/C18H28O4/c1-20-12-16(19)17(13-21-2)22-18(15-10-6-7-11-15)14-8-4-3-5-9-14/h3-5,8-9,15-19H,6-7,10-13H2,1-2H3/t16-,17-,18+/m0/s1
InChIKey KZLDPHNGBXOVKS-OKZBNKHCSA-N
Mol Weight 308.42 g/mol
Molecular Formula C18H28O4
Exact Mass 308.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3A6TSifwrpW
Name (2S,3S,1'S)-1,4-Di(methoxy)-2-[.alpha.-cyclopentylbenzoyly]butan-3-ol
Alternate Name(s) (2S,3S,1'S)-1,4-Di(methoxy)-2-[.alpha.-cyclopentylbenzoxy]butan-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O4
InChI InChI=1S/C18H28O4/c1-20-12-16(19)17(13-21-2)22-18(15-10-6-7-11-15)14-8-4-3-5-9-14/h3-5,8-9,15-19H,6-7,10-13H2,1-2H3/t16-,17-,18+/m0/s1
InChIKey KZLDPHNGBXOVKS-OKZBNKHCSA-N
Molecular Weight 308.418 g/mol
SMILES O[C@]([C@@](O[C@](c1ccccc1)(C1CCCC1)[H])(COC)[H])(COC)[H]
SPLASH splash10-0udi-1910000000-80bb21b7f29bc1cb903f
Source of Spectrum J-59-8195-4
Wiley ID 1309928