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1,3-Endo-4-Trimethylbicyclo[2.2.1]heptan-2-one
SpectraBase Compound ID KFCgnXcBIw
InChI InChI=1S/C10H16O/c1-7-8(11)10(3)5-4-9(7,2)6-10/h7H,4-6H2,1-3H3/t7-,9+,10-/m0/s1
InChIKey KJBKUPFGFHFZIJ-SFGNSQDASA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lgZYJKj9LP
Name 1,3-Endo-4-Trimethylbicyclo[2.2.1]heptan-2-one
Alternate Name(s) (1S,3R,4R)-1,3,4-trimethylbicyclo[2.2.1]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O
InChI InChI=1S/C10H16O/c1-7-8(11)10(3)5-4-9(7,2)6-10/h7H,4-6H2,1-3H3/t7-,9+,10-/m0/s1
InChIKey KJBKUPFGFHFZIJ-SFGNSQDASA-N
Literature Reference DOI 10.1021/jo500942a
Molecular Weight 152.237 g/mol
SMILES [C@@]1([H])([C@@]2(CC[C@@](C2)(C1=O)C)C)C
SPLASH splash10-0002-9200000000-8dd5c627c80d1977b1de
Source of Spectrum J-79-6729-((endo)_15b)
Wiley ID 1746304