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Pentaspiro[3.0.3.0.3.0.3.0.3.1]henicosan-21-one
SpectraBase Compound ID HkEFEJUXXb2
InChI InChI=1S/C21H30O/c22-16-17(6-1-7-17)19(10-3-11-19)21(14-5-15-21)20(12-4-13-20)18(16)8-2-9-18/h1-15H2
InChIKey FUDQHFHTHUBDLN-UHFFFAOYSA-N
Mol Weight 298.47 g/mol
Molecular Formula C21H30O
Exact Mass 298.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOQnPsRehH
Name Pentaspiro[3.0.3.0.3.0.3.0.3.1]henicosan-21-one
CAS Registry Number 89546-45-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O
InChI InChI=1S/C21H30O/c22-16-17(6-1-7-17)19(10-3-11-19)21(14-5-15-21)20(12-4-13-20)18(16)8-2-9-18/h1-15H2
InChIKey FUDQHFHTHUBDLN-UHFFFAOYSA-N
Molecular Weight 298.470 g/mol
SMILES C12(C3(C4(CCC4)C(C4(C11CCC1)CCC4)=O)CCC3)CCC2
SPLASH splash10-0006-9000000000-385bebaeb1f171d86f15
Source of Spectrum K-121-530-12
Wiley ID 1301615