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(3aR,4S,7R,7aS)-3a,4,7,7a-Tetrahydro-4,7-methanoisobenzofuran-1(3H)-one
SpectraBase Compound ID DfI8pNQxF0f
InChI InChI=1S/C9H10O2/c10-9-8-6-2-1-5(3-6)7(8)4-11-9/h1-2,5-8H,3-4H2/t5-,6+,7-,8+/m0/s1
InChIKey WOJWXGGCIZZKFQ-FKSUSPILSA-N
Mol Weight 150.18 g/mol
Molecular Formula C9H10O2
Exact Mass 150.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E17hZvuypQO
Name (3aR,4S,7R,7aS)-3a,4,7,7a-Tetrahydro-4,7-methanoisobenzofuran-1(3H)-one
Alternate Name(s) (3aS,4R,7S,7aR)-3a,4,7,7a-tetrahydro-4,7-methanoisobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c10-9-8-6-2-1-5(3-6)7(8)4-11-9/h1-2,5-8H,3-4H2/t5-,6+,7-,8+/m0/s1
InChIKey WOJWXGGCIZZKFQ-FKSUSPILSA-N
Molecular Weight 150.177 g/mol
SMILES [C@@]12(C=C[C@@](C2)([C@@]2(COC(=O)[C@]12[H])[H])[H])[H]
SPLASH splash10-014i-9000000000-4908b086f7030d0e769d
Source of Spectrum U1-2012-6644-34
Wiley ID 1735626