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5,8-Dihydroxy-2-heptyl-8a,1'-epoxy-(perhydro)-benzopyran
SpectraBase Compound ID 4xjxbTDlbWm
InChI InChI=1S/C16H28O4/c1-2-3-4-5-6-13-14-9-7-11-12(17)8-10-15(18)16(11,19-13)20-14/h11-15,17-18H,2-10H2,1H3/t11-,12-,13+,14+,15+,16+/m0/s1
InChIKey GBDGOAVPCDIMFE-KPRKPIBOSA-N
Mol Weight 284.4 g/mol
Molecular Formula C16H28O4
Exact Mass 284.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ekx0RqBEjNp
Name 5,8-Dihydroxy-2-heptyl-8a,1'-epoxy-(perhydro)-benzopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O4
InChI InChI=1S/C16H28O4/c1-2-3-4-5-6-13-14-9-7-11-12(17)8-10-15(18)16(11,19-13)20-14/h11-15,17-18H,2-10H2,1H3/t11-,12-,13+,14+,15+,16+/m0/s1
InChIKey GBDGOAVPCDIMFE-KPRKPIBOSA-N
Molecular Weight 284.396 g/mol
SMILES O[C@]1([C@]23[C@]([C@](CC1)(O)[H])(CC[C@](O3)([H])[C@](O2)(CCCCCC)[H])[H])[H]
SPLASH splash10-0fai-1900000000-9a18913698030586ecd0
Source of Spectrum G4-54-401-3
Wiley ID 1701980