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(+)-Methysticin
SpectraBase Compound ID EEet7jiFWnM
InChI InChI=1S/C15H14O5/c1-17-12-7-11(20-15(16)8-12)4-2-10-3-5-13-14(6-10)19-9-18-13/h2-6,8,11H,7,9H2,1H3/b4-2+
InChIKey GTEXBOVBADJOQH-DUXPYHPUSA-N
Mol Weight 274.27 g/mol
Molecular Formula C15H14O5
Exact Mass 274.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3wXHvbhnzR
Name (+)-Methysticin
CAS Registry Number 495-85-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O5
InChI InChI=1S/C15H14O5/c1-17-12-7-11(20-15(16)8-12)4-2-10-3-5-13-14(6-10)19-9-18-13/h2-6,8,11H,7,9H2,1H3/b4-2+
InChIKey GTEXBOVBADJOQH-DUXPYHPUSA-N
Molecular Weight 274.272 g/mol
SMILES C=1C(OC(\C=C\c2cc3OCOc3cc2)CC1OC)=O
SPLASH splash10-01s2-5900000000-6ab185b104cc6fc6cf62
Source of Spectrum KO-13-623-3
Synonyms (R)-5,6-dihydro-4-methoxy-6-(3,4-(methylenedioxy)styryl)-2H-pyran-2-one (r-(E))-6-(2-(1,3-benzodioxol-5-yl)ethenyl)-5,6-dihydro-4-methoxy-2H-pyran-2-one 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methoxy-2,3-dihydropyran-6-one 2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-4-methoxy-2,3-dihydropyran-6-one 5-Hydroxy-3-methoxy-7-(3,4-(methylenedioxy)phenyl)-2,6-heptadienoic acid gamma-lactone Kavahin Kavatin Methysticin BRN 0091701 NSC 112158
Wiley ID 1278044