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2,3-Diacetoxy-9-methyl-11-epi-Apotrichothecene
SpectraBase Compound ID FCp9qnnT0s3
InChI InChI=1S/C19H28O5/c1-12-6-8-17(4)16(10-12)24-19(11-22-13(2)20)15(23-14(3)21)7-9-18(17,19)5/h10,15-16H,6-9,11H2,1-5H3/t15?,16-,17-,18-,19-/m1/s1
InChIKey FHTHIJRRGKMFTF-CXOVQGTPSA-N
Mol Weight 336.43 g/mol
Molecular Formula C19H28O5
Exact Mass 336.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KBlhW2vUPu
Name 2,3-Diacetoxy-9-methyl-11-epi-Apotrichothecene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O5
InChI InChI=1S/C19H28O5/c1-12-6-8-17(4)16(10-12)24-19(11-22-13(2)20)15(23-14(3)21)7-9-18(17,19)5/h10,15-16H,6-9,11H2,1-5H3/t15?,16-,17-,18-,19-/m1/s1
InChIKey FHTHIJRRGKMFTF-CXOVQGTPSA-N
Molecular Weight 336.428 g/mol
SMILES [C@@]12([C@@]([C@@]3(CCC(=C[C@]3(O2)[H])C)C)(CCC1OC(=O)C)C)COC(=O)C
SPLASH splash10-0597-8911000000-6e6f6963e22c7f18bac9
Source of Spectrum X2-52-1270-19
Wiley ID 1603362