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Bicyclo[3.2.1]oct-3-ene-2,8-dione, 4-methyl-7-(1-methylethyl)-, (1R-endo)-
SpectraBase Compound ID 54nGbYtvpIp
InChI InChI=1S/C12H16O2/c1-6(2)8-5-9-7(3)4-10(13)11(8)12(9)14/h4,6,8-9,11H,5H2,1-3H3/t8-,9+,11+/m1/s1
InChIKey ZNDGVGHNYZUMBI-YWVKMMECSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdpzvXxRJTo
Name Bicyclo[3.2.1]oct-3-ene-2,8-dione, 4-methyl-7-(1-methylethyl)-, (1R-endo)-
CAS Registry Number 124890-53-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-6(2)8-5-9-7(3)4-10(13)11(8)12(9)14/h4,6,8-9,11H,5H2,1-3H3/t8-,9+,11+/m1/s1
InChIKey ZNDGVGHNYZUMBI-YWVKMMECSA-N
Molecular Weight 192.258 g/mol
SMILES [C@]12(C([C@@]([H])(C[C@@]2(C(C)C)[H])C(=CC1=O)C)=O)[H]
SPLASH splash10-0002-9800000000-1e2fb96940967edafc72
Source of Spectrum K-123-1086-20
Synonyms (1S,5S,7R)-4-Methyl-endo-7-(1-methylethyl)bicyclo[3.2.1]oct-3-ene-2,8-dione (1S,5S,7R)-7-isopropyl-4-methylbicyclo[3.2.1]oct-3-ene-2,8-dione
Wiley ID 1188750