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3,5-Methanobenzofuran-2(3H)-one, hexahydro-3-methyl-, (3.alpha.,3a.beta.,5.alpha.,7a.beta.)-
SpectraBase Compound ID 3En0inzwr4s
InChI InChI=1S/C10H14O2/c1-10-5-6-2-3-8(7(10)4-6)12-9(10)11/h6-8H,2-5H2,1H3/t6-,7-,8+,10-/m0/s1
InChIKey ZPAYFGDSUREGDX-OORONAJNSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JgQ0ATzDW5U
Name 3,5-Methanobenzofuran-2(3H)-one, hexahydro-3-methyl-, (3.alpha.,3a.beta.,5.alpha.,7a.beta.)-
Alternate Name(s) (1S,4R,7R,8R)-7-methyl-5-oxatricyclo[5.2.1.0(4,8)]decan-6-one 4-Methyl-2-oxatricyclo[5.2.1.0(4,9)]decane-3-one
CAS Registry Number 119867-24-2
Comments Removed - unrepairable contamination (CH2Cl2)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-10-5-6-2-3-8(7(10)4-6)12-9(10)11/h6-8H,2-5H2,1H3/t6-,7-,8+,10-/m0/s1
InChIKey ZPAYFGDSUREGDX-OORONAJNSA-N
Molecular Weight 166.220 g/mol
SMILES [C@@]12(C(O[C@]3([C@@]2(C[C@@](C1)(CC3)[H])[H])[H])=O)C
SPLASH splash10-000y-9000000000-5269467684537f37401e
Source of Spectrum F-44-4678-22
Wiley ID 1162662