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1-(3-Oxobutyl)-2-adamantanone
SpectraBase Compound ID B2wfAZtnmw0
InChI InChI=1S/C14H20O2/c1-9(15)2-3-14-7-10-4-11(8-14)6-12(5-10)13(14)16/h10-12H,2-8H2,1H3/t10-,11?,12?,14+/m1/s1
InChIKey CXXDKASZDALDOG-NPZBDFSRSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YLcah0LGGA
Name 1-(3-Oxobutyl)-2-adamantanone
CAS Registry Number 144436-30-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-9(15)2-3-14-7-10-4-11(8-14)6-12(5-10)13(14)16/h10-12H,2-8H2,1H3/t10-,11?,12?,14+/m1/s1
InChIKey CXXDKASZDALDOG-NPZBDFSRSA-N
Molecular Weight 220.312 g/mol
SMILES [C@]12(C(C3CC(C2)C[C@@](C1)(C3)[H])=O)CCC(=O)C
SPLASH splash10-00fr-2960000000-f7119ba3343dfc84d645
Source of Spectrum J-58-254-9
Wiley ID 1220294