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2-((1R,4S)-3-acetyl-4-methyl-4-((E)-3-oxoprop-1-en-1-yl)cyclohexyl)acrylic acid
SpectraBase Compound ID Lc37pDmn66V
InChI InChI=1S/C15H20O4/c1-10(14(18)19)12-5-7-15(3,6-4-8-16)13(9-12)11(2)17/h4,6,8,12-13H,1,5,7,9H2,2-3H3,(H,18,19)/b6-4+/t12-,13?,15-/m1/s1
InChIKey HFNWBPAIBHCMOL-DEPLQUNZSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSXhuTxmNGG
Name 2-((1R,4S)-3-acetyl-4-methyl-4-((E)-3-oxoprop-1-en-1-yl)cyclohexyl)acrylic acid
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Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-10(14(18)19)12-5-7-15(3,6-4-8-16)13(9-12)11(2)17/h4,6,8,12-13H,1,5,7,9H2,2-3H3,(H,18,19)/b6-4+/t12-,13?,15-/m1/s1
InChIKey HFNWBPAIBHCMOL-DEPLQUNZSA-N
Molecular Weight 264.321 g/mol
SMILES OC(C([C@@]1(CC[C@@](\C=C\C=O)(C(C1)C(=O)C)C)[H])=C)=O
SPLASH splash10-0f6x-9840000000-769399ca268c5aa7c89d
Wiley ID 1817163