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Tricyclo[5.5.0.1(2,5)]dodec-3-en-11-one isomer
SpectraBase Compound ID 1hMbzc4ZduH
InChI InChI=1S/C12H16O/c13-11-4-2-1-3-10-8-5-6-9(7-8)12(10)11/h5-6,8-10,12H,1-4,7H2/t8-,9+,10?,12?/m0/s1
InChIKey XAZLOTBLZIKARI-SKMKEBHYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EUAb9i9IHV
Name Tricyclo[5.5.0.1(2,5)]dodec-3-en-11-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c13-11-4-2-1-3-10-8-5-6-9(7-8)12(10)11/h5-6,8-10,12H,1-4,7H2/t8-,9+,10?,12?/m0/s1
InChIKey XAZLOTBLZIKARI-SKMKEBHYSA-N
Molecular Weight 176.259 g/mol
SMILES [C@@]12(C3C(CCCCC3=O)[C@](C1)(C=C2)[H])[H]
SPLASH splash10-014i-9400000000-28ac48d8423bfd68c432
Source of Spectrum Y1-35-712-2
Synonyms endo-Tricyclo[5.5.0.1(2,5)]dodec-3-en-11-one
Wiley ID 1526786