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Pentacyclo[5.5.0.0(2,6).0(3,10).0(5,9)]dodecan-9-one
SpectraBase Compound ID 1AAYwrVUdXV
InChI InChI=1S/C12H14O/c13-9-3-5-4-1-8-10-6(4)2-7(5)12(10)11(8)9/h4-8,10-12H,1-3H2/t4-,5+,6+,7-,8-,10+,11+,12+/m1/s1
InChIKey UGBVAKXSQFUTNK-ZHVWPRJQSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoH2PfBzZtH
Name Pentacyclo[5.5.0.0(2,6).0(3,10).0(5,9)]dodecan-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c13-9-3-5-4-1-8-10-6(4)2-7(5)12(10)11(8)9/h4-8,10-12H,1-3H2/t4-,5+,6+,7-,8-,10+,11+,12+/m1/s1
InChIKey UGBVAKXSQFUTNK-ZHVWPRJQSA-N
Molecular Weight 174.243 g/mol
SMILES [C@@]12([C@]3([C@]4(C[C@@]2([C@@]2([C@]4(C[C@]3([C@]1(C(=O)C2)[H])[H])[H])[H])[H])[H])[H])[H]
SPLASH splash10-0a4i-7900000000-a49f5051a16f7de2b2ef
Source of Spectrum F-54-5111-5
Synonyms Pentacyclo[5.5.0.0(2,6).0(3,10).0(5,9)]dodecan-12-one
Wiley ID 806675