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Rac-(3aR,4R,7S,7aR,8S)-8-Methoxy-4-pentylhexahydro-4,7-methanobenzofuran-2(3H)-one
SpectraBase Compound ID Bh20FFQKird
InChI InChI=1S/C15H24O3/c1-3-4-5-7-15-8-6-10(14(15)17-2)13-11(15)9-12(16)18-13/h10-11,13-14H,3-9H2,1-2H3/t10-,11-,13-,14-,15+/m1/s1
InChIKey DXMZSJBLZKFSDE-BBIZWXPBSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yeRGllfk
Name Rac-(3aR,4R,7S,7aR,8S)-8-Methoxy-4-pentylhexahydro-4,7-methanobenzofuran-2(3H)-one
Alternate Name(s) (3aS,4S,7R,7aS,8R)-8-methoxy-4-pentylhexahydro-4,7-methanobenzofuran-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-3-4-5-7-15-8-6-10(14(15)17-2)13-11(15)9-12(16)18-13/h10-11,13-14H,3-9H2,1-2H3/t10-,11-,13-,14-,15+/m1/s1
InChIKey DXMZSJBLZKFSDE-BBIZWXPBSA-N
Literature Reference DOI 10.1021/jo500942a
Molecular Weight 252.354 g/mol
SMILES [C@]1([C@@]2([C@@]3(CC(O[C@@]3([C@]1(CC2)[H])[H])=O)[H])CCCCC)(OC)[H]
SPLASH splash10-022c-7920000000-308316dae4bd7b8a41f3
Source of Spectrum J-79-6730-28b
Wiley ID 1746314