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(4R,7E,9R,10S,13E,16S)-4,10,16-trimethyl-9-oxidanyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione
SpectraBase Compound ID 6Em62gUS71U
InChI InChI=1S/C16H22O7/c1-10-5-4-6-14(18)23-12(3)13(17)7-8-15(19)22-11(2)9-16(20)21-10/h4,6-8,10-13,17H,5,9H2,1-3H3/b6-4+,8-7+/t10-,11+,12-,13+/m0/s1
InChIKey QTVMZKJQTJNPJL-VCPJVSAUSA-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 1Avql86vJd6
Name (4R,7E,9R,10S,13E,16S)-4,10,16-trimethyl-9-oxidanyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione
Alternate Name(s) (4R,7E,9R,10S,13E,16S)-9-hydroxy-4,10,16-trimethyl-1,5,11-trioxacyclohexadeca-7,13-diene-2,6,12-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O7
InChI InChI=1S/C16H22O7/c1-10-5-4-6-14(18)23-12(3)13(17)7-8-15(19)22-11(2)9-16(20)21-10/h4,6-8,10-13,17H,5,9H2,1-3H3/b6-4+,8-7+/t10-,11+,12-,13+/m0/s1
InChIKey QTVMZKJQTJNPJL-VCPJVSAUSA-N
Molecular Weight 326.345 g/mol
SMILES O[C@]1([C@](C)(OC(\C=C\C[C@@](OC(C[C@](OC(\C=C\1)=O)(C)[H])=O)(C)[H])=O)[H])[H]
SPLASH splash10-03yi-9600000000-633cb29a603ecece6a9e
Source of Spectrum K-2001-3051-3
Wiley ID 1580039