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(-)-6beta-Acetoxy-7alpha-hydroxymethyl-1alpha-methoxy-1,4aalpha,5,6,7,7aalpha-hexahydrocyclopenta[c]-pyran-4-carboxylic acid-methylester
SpectraBase Compound ID 8mIChgMookj
InChI InChI=1S/C14H20O7/c1-7(16)21-11-4-8-10(13(17)18-2)6-20-14(19-3)12(8)9(11)5-15/h6,8-9,11-12,14-15H,4-5H2,1-3H3/t8-,9+,11-,12+,14-/m1/s1
InChIKey XXTOGVQBLSNSAP-HOVHJQPKSA-N
Mol Weight 300.31 g/mol
Molecular Formula C14H20O7
Exact Mass 300.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tbqGcfOniz
Name (-)-6beta-Acetoxy-7alpha-hydroxymethyl-1alpha-methoxy-1,4aalpha,5,6,7,7aalpha-hexahydrocyclopenta[c]-pyran-4-carboxylic acid-methylester
Alternate Name(s) Methyl (1R,4aS,6R,7S,7aS)-6-acetoxy-7-(hydroxymethyl)-1-methoxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O7
InChI InChI=1S/C14H20O7/c1-7(16)21-11-4-8-10(13(17)18-2)6-20-14(19-3)12(8)9(11)5-15/h6,8-9,11-12,14-15H,4-5H2,1-3H3/t8-,9+,11-,12+,14-/m1/s1
InChIKey XXTOGVQBLSNSAP-HOVHJQPKSA-N
Molecular Weight 300.307 g/mol
SMILES OC[C@@]1([C@@]2([C@](C[C@]1(OC(C)=O)[H])(C(=CO[C@]2(OC)[H])C(OC)=O)[H])[H])[H]
SPLASH splash10-052f-0793000000-3ef351c856a4ac3fd876
Source of Spectrum K-107-2507-11a
Wiley ID 1793716