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1-Adamantyl 1-benzyl-1-ethylcyclopentyl ketone isomer
SpectraBase Compound ID GpuDvsG1D1I
InChI InChI=1S/C25H34O/c1-18(11-19-7-3-2-4-8-19)23(26)25(9-5-6-10-25)24-15-20-12-21(16-24)14-22(13-20)17-24/h2-4,7-8,18,20-22H,5-6,9-17H2,1H3/t18?,20-,21+,22-,24-
InChIKey AGGDJZOPOGAUES-DHBAEDPMSA-N
Mol Weight 350.5 g/mol
Molecular Formula C25H34O
Exact Mass 350.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7CxHFvA4abB
Name 1-Adamantyl 1-benzyl-1-ethylcyclopentyl ketone isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O
InChI InChI=1S/C25H34O/c1-18(11-19-7-3-2-4-8-19)23(26)25(9-5-6-10-25)24-15-20-12-21(16-24)14-22(13-20)17-24/h2-4,7-8,18,20-22H,5-6,9-17H2,1H3/t18?,20-,21+,22-,24-
InChIKey AGGDJZOPOGAUES-DHBAEDPMSA-N
Molecular Weight 350.546 g/mol
SMILES C12(C3(C(C(Cc4ccccc4)C)=O)CCCC3)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-000i-0900000000-1c1767ddad79fb7e8718
Source of Spectrum KC-0-199-6
Synonyms 1-[1-(1-adamantyl)cyclopentyl]-2-methyl-3-phenyl-1-propanone
Wiley ID 820932