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4,11,11-Trimethyl-12-oxatricyclo[5.3.1.(1,7).1(5,9)]dodec-3-ene-2,6-dione
SpectraBase Compound ID BRHaiBkwFyU
InChI InChI=1S/C14H18O3/c1-7-4-11(15)9-5-8-6-10(14(9,2)3)12(16)13(7)17-8/h4,8-10,13H,5-6H2,1-3H3/b7-4-/t8-,9+,10+,13+/m1/s1
InChIKey HKSFRCAUJJDDHW-IEZJHFCFSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22R1OPUkypw
Name 4,11,11-Trimethyl-12-oxatricyclo[5.3.1.(1,7).1(5,9)]dodec-3-ene-2,6-dione
Alternate Name(s) 4,8,8-trimethyl-2-oxatricyclo[5.3.1.1(3,9)]dodec-4-ene-6,12-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-7-4-11(15)9-5-8-6-10(14(9,2)3)12(16)13(7)17-8/h4,8-10,13H,5-6H2,1-3H3/b7-4-/t8-,9+,10+,13+/m1/s1
InChIKey HKSFRCAUJJDDHW-IEZJHFCFSA-N
Molecular Weight 234.295 g/mol
SMILES [C@@]12(C([C@@]3(C(=O)\C=C/([C@@](C2=O)(O[C@@](C1)(C3)[H])[H])C)[H])(C)C)[H]
SPLASH splash10-066r-9620000000-e372bcf9ab468b1e6cfb
Source of Spectrum F-51-9002-11
Wiley ID 793104