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(1R,4R,6S)-5-Isopropylidene-4-[(S)-2-(4-methoxybenzyloxy)-1-methylethyl]-3-oxabicyclo-[4.1.0]heptane
SpectraBase Compound ID HlRdKHdjVvw
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-PFSLXQJOSA-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 CTZ3jWTJZe4
Name (1R,4R,6S)-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-PFSLXQJOSA-N
Literature Reference DOI 10.1021/ol101741f
Molecular Weight 316.441 g/mol
SMILES C1[C@]2([C@@](C([C@@]([C@](COCc3ccc(cc3)OC)(C)[H])(O1)[H])=C(C)C)(C2)[H])[H]
SPLASH splash10-059i-3900000000-5a5845dc47d462bed7db
Source of Spectrum A1-12-4144/SMS23-28
Synonyms (1R,4R,6S)-4-((S)-1-((4-methoxybenzyl)oxy)propan-2-yl)-5-(propan-2-ylidene)-3-oxabicyclo[4.1.0]heptane
Wiley ID 1752540