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(2S,3aS,4R,7aS)-7-chloro-2-(4-methoxyphenyl)-3a,4,5,7a-tetrahydrobenzo[d][1,3]dioxol-4-ol
SpectraBase Compound ID D0XoMqg2Vst
InChI InChI=1S/C14H15ClO4/c1-17-9-4-2-8(3-5-9)14-18-12-10(15)6-7-11(16)13(12)19-14/h2-6,11-14,16H,7H2,1H3/t11-,12-,13+,14-/m1/s1
InChIKey WLZNUYMHCNXYOB-YIYPIFLZSA-N
Mol Weight 282.72 g/mol
Molecular Formula C14H15ClO4
Exact Mass 282.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QbtJRlG0qn
Name (2S,3aS,4R,7aS)-7-chloro-2-(4-methoxyphenyl)-3a,4,5,7a-tetrahydrobenzo[d][1,3]dioxol-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15ClO4
InChI InChI=1S/C14H15ClO4/c1-17-9-4-2-8(3-5-9)14-18-12-10(15)6-7-11(16)13(12)19-14/h2-6,11-14,16H,7H2,1H3/t11-,12-,13+,14-/m1/s1
InChIKey WLZNUYMHCNXYOB-YIYPIFLZSA-N
Literature Reference DOI 10.1021/ol801815k
Molecular Weight 282.723 g/mol
SMILES O[C@]1([C@@]2(O[C@@](O[C@@]2(C(Cl)=CC1)[H])(c1ccc(cc1)OC)[H])[H])[H]
SPLASH splash10-052r-5920000000-f313ad32a9d10884632e
Source of Spectrum A1-10-4693/SMS4-7
Wiley ID 1759933