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(1R,4R)-4-acetyl-1-methylbicyclo[4.1.0]heptan-2-one
SpectraBase Compound ID AGWTXINlN8S
InChI InChI=1S/C10H14O2/c1-6(11)7-3-8-5-10(8,2)9(12)4-7/h7-8H,3-5H2,1-2H3/t7-,8?,10-/m1/s1
InChIKey BZOXODYSAZYYNZ-HUWCLSLFSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Lh2YN8W4hB
Name (1R,4R)-4-acetyl-1-methylbicyclo[4.1.0]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-6(11)7-3-8-5-10(8,2)9(12)4-7/h7-8H,3-5H2,1-2H3/t7-,8?,10-/m1/s1
InChIKey BZOXODYSAZYYNZ-HUWCLSLFSA-N
Molecular Weight 166.220 g/mol
SMILES [C@@]12(C(C[C@](CC2=O)(C(=O)C)[H])C1)C
SPLASH splash10-0007-9300000000-10e457eb5ee057121c22
Source of Spectrum F-53-8077-9
Synonyms (1R,4R,6S)-4-Acetyl-1-methylbicyclo[4.1.0]heptan-2-one
Wiley ID 802488