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Phomochromone B
SpectraBase Compound ID 2Hq2blvpkCy
InChI InChI=1S/C12H14O4/c1-5-4-8-11(15)10(14)7(3)16-12(8)6(2)9(5)13/h4,7,10,13-14H,1-3H3/t7-,10+/m0/s1
InChIKey HDKWMJBKSLIKEN-OIBJUYFYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2It31V0MlE
Name Phomochromone B
Comments Less than 3 mono-isotopic peaks
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Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-5-4-8-11(15)10(14)7(3)16-12(8)6(2)9(5)13/h4,7,10,13-14H,1-3H3/t7-,10+/m0/s1
InChIKey HDKWMJBKSLIKEN-OIBJUYFYSA-N
Molecular Weight 222.240 g/mol
SMILES O[C@@]1([C@@](Oc2c(cc(c(c2C)O)C)C1=O)(C)[H])[H]
SPLASH splash10-0a4i-0090000000-51396134e80b97a3f178
Source of Spectrum U1-2011-2871-2
Synonyms (2S,3R)-3,7-dihydroxy-2,6,8-trimethyl-3,4-dihydro-2H-1-benzopyran-4-one (2S,3R)-3,7-dihydroxy-2,6,8-trimethyl-2,3-dihydrochromen-4-one (2S,3R)-2,6,8-trimethyl-3,7-bis(oxidanyl)-2,3-dihydrochromen-4-one
Wiley ID 1665396