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8-Dehydro-7-dehydroxyloganin methyl ether
SpectraBase Compound ID EwRZVibHi76
InChI InChI=1S/C12H16O4/c1-7-4-5-8-9(11(13)14-2)6-16-12(15-3)10(7)8/h4,6,8,10,12H,5H2,1-3H3
InChIKey LVZMWIHFVFAXJF-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hyvUylWIR6
Name 8-Dehydro-7-dehydroxyloganin methyl ether
Alternate Name(s) Methyl 1-methoxy-7-methyl-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
CAS Registry Number 18504-30-8
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-7-4-5-8-9(11(13)14-2)6-16-12(15-3)10(7)8/h4,6,8,10,12H,5H2,1-3H3
InChIKey LVZMWIHFVFAXJF-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES C1C=C(C)C2C1C(=COC2OC)C(OC)=O
SPLASH splash10-024l-5900000000-6370786d79f581ac175e
Source of Spectrum T-67-2421-0
Wiley ID 1224960