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1-Adamantylacetone
SpectraBase Compound ID 3n526tUMDHz
InChI InChI=1S/C13H20O/c1-9(14)5-13-6-10-2-11(7-13)4-12(3-10)8-13/h10-12H,2-8H2,1H3/t10-,11+,12-,13+
InChIKey AIDPAFBRBBMNEH-MPZDIEGVSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kkDlWIL7wG
Name 1-Adamantylacetone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-9(14)5-13-6-10-2-11(7-13)4-12(3-10)8-13/h10-12H,2-8H2,1H3/t10-,11+,12-,13+
InChIKey AIDPAFBRBBMNEH-MPZDIEGVSA-N
Molecular Weight 192.302 g/mol
SMILES CC(=O)CC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H]
SPLASH splash10-000l-9700000000-90ff76a47b218e21c165
Source of Spectrum KC-0-2581-0
Synonyms 1-(1-adamantyl)-2-propanone 1-(1-Adamantyl)acetone 1-(1-adamantyl)propan-2-one
Wiley ID 821559