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8-Acetoxy-2-(1'-acetoxyheptyl)-2,3,4,6,7,8-hexahydrobenzopyran-5(5H)-one
SpectraBase Compound ID rmbvt21ABu
InChI InChI=1S/C20H30O6/c1-4-5-6-7-8-17(24-13(2)21)18-11-9-15-16(23)10-12-19(20(15)26-18)25-14(3)22/h17-19H,4-12H2,1-3H3/t17?,18-,19-/m0/s1
InChIKey VHFSMUUDRAOURA-MNNMKWMVSA-N
Mol Weight 366.45 g/mol
Molecular Formula C20H30O6
Exact Mass 366.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FyPil07yxqr
Name 8-Acetoxy-2-(1'-acetoxyheptyl)-2,3,4,6,7,8-hexahydrobenzopyran-5(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O6
InChI InChI=1S/C20H30O6/c1-4-5-6-7-8-17(24-13(2)21)18-11-9-15-16(23)10-12-19(20(15)26-18)25-14(3)22/h17-19H,4-12H2,1-3H3/t17?,18-,19-/m0/s1
InChIKey VHFSMUUDRAOURA-MNNMKWMVSA-N
Molecular Weight 366.454 g/mol
SMILES C12=C(C(CC[C@@]2(OC(=O)C)[H])=O)CC[C@](O1)(C(OC(=O)C)CCCCCC)[H]
SPLASH splash10-004i-0941000000-eee0cf820d4c14748d37
Source of Spectrum G4-54-401-6
Wiley ID 1701978