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(1S,4S,6R)-5-Isopropylidene-4-[(S)-2-(4-methoxybenzyloxy)-1-methylethyl]-3-oxabicyclo-[4.1.0]heptane

View entire compound with spectra: 1 MS (GC)

(1S,4S,6R)-5-Isopropylidene-4-[(S)-2-(4-methoxybenzyloxy)-1-methylethyl]-3-oxabicyclo-[4.1.0]heptane
SpectraBase Compound ID LNaDsf7RMdE
InChI InChI=1S/C20H28O3/c1-13(2)19-18-9-16(18)12-23-20(19)14(3)10-22-11-15-5-7-17(21-4)8-6-15/h5-8,14,16,18,20H,9-12H2,1-4H3/t14-,16+,18+,20-/m0/s1
InChIKey WMJJYMRCVMNPLK-UQWBFEFOSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AOImICul0dC
Name (1S,4S,6R)-5-Isopropylidene-4-[(S)-2-(4-methoxybenzyloxy)-1-methylethyl]-3-oxabicyclo-[4.1.0]heptane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-13(2)19-18-9-16(18)12-23-20(19)14(3)10-22-11-15-5-7-17(21-4)8-6-15/h5-8,14,16,18,20H,9-12H2,1-4H3/t14-,16+,18+,20-/m0/s1
InChIKey WMJJYMRCVMNPLK-UQWBFEFOSA-N
Literature Reference DOI 10.1021/ol101741f
Molecular Weight 316.441 g/mol
SMILES C1[C@]2(C(=C(C)C)[C@]([C@](COCc3ccc(cc3)OC)(C)[H])(OC[C@@]12[H])[H])[H]
SPLASH splash10-059i-2900000000-f4a6e690bf908c3ee4b1
Source of Spectrum A1-12-4144/SMS24-30
Synonyms (1S,4S,6R)-4-((S)-1-((4-methoxybenzyl)oxy)propan-2-yl)-5-(propan-2-ylidene)-3-oxabicyclo[4.1.0]heptane
Wiley ID 1752543