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1,5-Di-tet-Butyl-8-(2-hydroxyisopropyl)-3,3-(oxoethylidenedioxy)bicyclo[2.2.2]octa-5,7-dien-2-one
SpectraBase Compound ID BfvmNdbzbIV
InChI InChI=1S/C21H30O5/c1-17(2,3)12-9-20(18(4,5)6)10-13(19(7,8)24)15(12)21(16(20)23)25-11-14(22)26-21/h9-10,15,24H,11H2,1-8H3/t15-,20-,21+/m0/s1
InChIKey UWIMBMZNJQMOII-ONGXBYRLSA-N
Mol Weight 362.47 g/mol
Molecular Formula C21H30O5
Exact Mass 362.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CshUXXDG3Gi
Name 1,5-Di-tet-Butyl-8-(2-hydroxyisopropyl)-3,3-(oxoethylidenedioxy)bicyclo[2.2.2]octa-5,7-dien-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O5
InChI InChI=1S/C21H30O5/c1-17(2,3)12-9-20(18(4,5)6)10-13(19(7,8)24)15(12)21(16(20)23)25-11-14(22)26-21/h9-10,15,24H,11H2,1-8H3/t15-,20-,21+/m0/s1
InChIKey UWIMBMZNJQMOII-ONGXBYRLSA-N
Molecular Weight 362.466 g/mol
SMILES OC(C=1[C@]2([C@]3(C([C@@](C1)(C=C2C(C)(C)C)C(C)(C)C)=O)OC(=O)CO3)[H])(C)C
SPLASH splash10-00o0-0190000000-9a3e6819379d08079e0f
Source of Spectrum QA-33-78-15
Wiley ID 861017