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Methysticin
SpectraBase Compound ID ErGgwu2X2wa
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+/t11-/m0/s1
InChIKey GTEXBOVBADJOQH-FWEMWIAWSA-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 4YxFJXbreAq
Name Methysticin
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+/t11-/m0/s1
InChIKey GTEXBOVBADJOQH-FWEMWIAWSA-N
Instrument Name Finnigan MAT 4500
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290070311
Molecular Weight 274.272 g/mol
SMILES c1c2c(ccc1\C=C\[C@@]1(OC(C=C(C1)OC)=O)[H])OCO2
SPLASH splash10-0072-1930000000-53d2dcb0515cfdbb249a
Source of Spectrum RCM-7-222-11
Wiley ID 1837289