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3H-3a,6-Epoxyisobenzofuran-4,5,7-trimethanol, hexahydro-3-methoxy-, triacetate
SpectraBase Compound ID GJhPWK5mWJy
InChI InChI=1S/C18H26O9/c1-9(19)23-5-12-14(7-25-11(3)21)18-15(8-26-17(18)22-4)13(16(12)27-18)6-24-10(2)20/h12-17H,5-8H2,1-4H3/t12-,13?,14-,15?,16+,17?,18+/m1/s1
InChIKey XZVFHKAFIOLDFM-IDKBMQSQSA-N
Mol Weight 386.4 g/mol
Molecular Formula C18H26O9
Exact Mass 386.157682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13FZiFoIjj6
Name 3H-3a,6-Epoxyisobenzofuran-4,5,7-trimethanol, hexahydro-3-methoxy-, triacetate
Alternate Name(s) SR),5SR,6RS,7RS,8SR,9RS)-2-methoxy-3,10-dioxatricyclo[5.2.1.0]decane-6-exo,8-exo,9-exo-trimethyl]triacetate [(1rs,2(rs {6,8-bis[(acetyloxy)methyl]-2-methoxy-3,10-dioxatricyclo[5.2.1.0(1,5)]dec-9-yl}methyl acetate
CAS Registry Number 107446-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O9
InChI InChI=1S/C18H26O9/c1-9(19)23-5-12-14(7-25-11(3)21)18-15(8-26-17(18)22-4)13(16(12)27-18)6-24-10(2)20/h12-17H,5-8H2,1-4H3/t12-,13?,14-,15?,16+,17?,18+/m1/s1
InChIKey XZVFHKAFIOLDFM-IDKBMQSQSA-N
Molecular Weight 386.397 g/mol
SMILES [C@]123C(C(COC(=O)C)[C@@](O3)([C@@]([C@]1(COC(=O)C)[H])(COC(=O)C)[H])[H])COC2OC
SPLASH splash10-0006-9100000000-0c2b01b664e162e369e4
Source of Spectrum H-69-1300-22
Wiley ID 1362471