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LFFHYMMJLNEHLM-UHFFFAOYSA-N

View entire compound with spectra: 20 NMR, and 2 MS (GC)

LFFHYMMJLNEHLM-UHFFFAOYSA-N
SpectraBase Compound ID EjyXGK0x9Hv
InChI InChI=1S/C8H12O/c1-5-4-7-6(5)2-3-8(7)9/h5-7H,2-4H2,1H3
InChIKey LFFHYMMJLNEHLM-UHFFFAOYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lrTpweH8e4
Name (endo)-6-Methylbicyclo[3.2.0]heptan-2-one
Alternate Name(s) (exo)-6-Methylbicyclo[3.2.0]heptan-2-one 6-Methylbicyclo[3.2.0]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c1-5-4-7-6(5)2-3-8(7)9/h5-7H,2-4H2,1H3
InChIKey LFFHYMMJLNEHLM-UHFFFAOYSA-N
Molecular Weight 124.183 g/mol
SMILES C12C(CCC2=O)C(C1)C
SPLASH splash10-001i-9200000000-3938a21ca1dd4f789afe
Source of Spectrum SB-47-923-0
Wiley ID 1129083