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Phoracantholide
SpectraBase Compound ID rwci36Qm06
InChI InChI=1S/C10H18O2/c1-9-7-5-3-2-4-6-8-10(11)12-9/h9H,2-8H2,1H3/t9-/m1/s1
InChIKey SAMJSVOFANTIOD-SECBINFHSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ptkSTaTKyV
Name Phoracantholide
Alternate Name(s) (10R)-10-methyl-2-oxecanone (R)-10-Methyl-oxecan-2-one (10R)-10-methyloxecan-2-one 2-Methyl-4-oxecanone
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Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-9-7-5-3-2-4-6-8-10(11)12-9/h9H,2-8H2,1H3/t9-/m1/s1
InChIKey SAMJSVOFANTIOD-SECBINFHSA-N
Molecular Weight 170.252 g/mol
SMILES C1(O[C@@](CCCCCCC1)(C)[H])=O
SPLASH splash10-00di-3900000000-c4ef5b0548ab06be4d58
Source of Spectrum F-52-4590-3
Wiley ID 796210