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Bicyclo[2.2.2]octane-2,5-dione, 1-methoxy-8-methyl-, (1.alpha.,4.beta.,8S*)-
SpectraBase Compound ID 1okgtM9gv
InChI InChI=1S/C10H14O3/c1-6-4-10(13-2)5-8(11)7(6)3-9(10)12/h6-7H,3-5H2,1-2H3/t6-,7-,10-/m0/s1
InChIKey XKWTXUJMLXYVAW-BYULHYEWSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tSDJvBYEbO
Name Bicyclo[2.2.2]octane-2,5-dione, 1-methoxy-8-methyl-, (1.alpha.,4.beta.,8S*)-
CAS Registry Number 130472-17-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-6-4-10(13-2)5-8(11)7(6)3-9(10)12/h6-7H,3-5H2,1-2H3/t6-,7-,10-/m0/s1
InChIKey XKWTXUJMLXYVAW-BYULHYEWSA-N
Molecular Weight 182.219 g/mol
SMILES [C@@]12(C(C[C@]([C@](C2)(C)[H])([H])C(C1)=O)=O)OC
SPLASH splash10-0bti-4900000000-74e10fc5c9d974c7baa6
Source of Spectrum KC-1990-1396-18
Synonyms (1R(*),8S(*))-1-methoxy-8-methylbicyclo[2.2.2]octane-2,5-dione (1R,4S,8S)-1-methoxy-8-methylbicyclo[2.2.2]octane-2,5-dione
Wiley ID 1178494