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1,3,3-Trimethyl-4-methylethyl-bicyclo[2.2.2]octan-2-one
SpectraBase Compound ID GlTfPgCmpLm
InChI InChI=1S/C14H24O/c1-10(2)14-8-6-13(5,7-9-14)11(15)12(14,3)4/h10H,6-9H2,1-5H3/t13-,14+
InChIKey JPRCRZOIFDQIEV-OKILXGFUSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JwasiVtuKx1
Name 1,3,3-Trimethyl-4-methylethyl-bicyclo[2.2.2]octan-2-one
Classification Ketones
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 208.182715392 u
Formula C14H24O
InChI InChI=1S/C14H24O/c1-10(2)14-8-6-13(5,7-9-14)11(15)12(14,3)4/h10H,6-9H2,1-5H3/t13-,14+
InChIKey JPRCRZOIFDQIEV-OKILXGFUSA-N
Molecular Weight 208.345 g/mol
Number of Peaks 8
SMILES C1[C@]2(C(C([C@@](C1)(CC2)C)=O)(C)C)C(C)C
SPLASH splash10-000i-1920000000-669010e6b936d646d7a4
Source of Spectrum FF-8-300-20 (DOI: 10.1002/ffj.2730080603)
Synonyms (1s,4s)-4-isopropyl-1,3,3-trimethylbicyclo[2.2.2]octan-2-one
Wiley ID 1801261