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(2r,4r)-4-acetoxy-5-methoxy-2,4-dimethyl-2-((2r)-2-methylbutyryloxy)-5-cyclohexen-1,3-dione
SpectraBase Compound ID 3QfG1n4sFW3
InChI InChI=1S/C16H22O7/c1-7-9(2)13(19)23-15(4)11(18)8-12(21-6)16(5,14(15)20)22-10(3)17/h8-9H,7H2,1-6H3/t9-,15-,16-/m1/s1
InChIKey SZGRMGXVXUKNDH-FWGMWULZSA-N
Mol Weight 326.35 g/mol
Molecular Formula C16H22O7
Exact Mass 326.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lg1Jh0Vqstl
Name (2r,4r)-4-acetoxy-5-methoxy-2,4-dimethyl-2-((2r)-2-methylbutyryloxy)-5-cyclohexen-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O7
InChI InChI=1S/C16H22O7/c1-7-9(2)13(19)23-15(4)11(18)8-12(21-6)16(5,14(15)20)22-10(3)17/h8-9H,7H2,1-6H3/t9-,15-,16-/m1/s1
InChIKey SZGRMGXVXUKNDH-FWGMWULZSA-N
Ionization Type EI-B
Molecular Weight 326.345 g/mol
SMILES C1([C@](C([C@](C(=C1)OC)(C)OC(=O)C)=O)(OC(=O)[C@@](CC)(C)[H])C)=O
SPLASH splash10-0a59-6900000000-9316a83344806c0e7fca
Source of Spectrum SRH-2022-6669-0
Wiley ID 1828496