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(3aS,4R,6aS)-2-Methyl-4-phenylhexahydro-2H-furo[3,4-b]furan isomer

View entire compound with spectra: 2 MS (GC)

(3aS,4R,6aS)-2-Methyl-4-phenylhexahydro-2H-furo[3,4-b]furan isomer
SpectraBase Compound ID Ir868y7QSoL
InChI InChI=1S/C13H16O2/c1-9-7-11-12(15-9)8-14-13(11)10-5-3-2-4-6-10/h2-6,9,11-13H,7-8H2,1H3/t9?,11-,12-,13+/m1/s1
InChIKey WWFDGLTUWDTYLU-PUISIEQESA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ELMF5oTYKB
Name (3aS,4R,6aS)-2-Methyl-4-phenylhexahydro-2H-furo[3,4-b]furan isomer
Alternate Name(s) (3aS,4R,6aS)-2-Methyl-4-phenylhexahydro-2H-furo[3,4-b]furan (3aS,4R,6aS)-2-methyl-4-phenylhexahydrofuro[3,4-b]furan
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Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-9-7-11-12(15-9)8-14-13(11)10-5-3-2-4-6-10/h2-6,9,11-13H,7-8H2,1H3/t9?,11-,12-,13+/m1/s1
InChIKey WWFDGLTUWDTYLU-PUISIEQESA-N
Molecular Weight 204.269 g/mol
SMILES [C@]12([C@@](OC[C@]2(OC(C1)C)[H])(c1ccccc1)[H])[H]
SPLASH splash10-0f89-5910000000-cfa27f8a5aea030347e5
Source of Spectrum KD-15-1954-20
Wiley ID 1637128