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FUNEBrADIOL
SpectraBase Compound ID Jhs2wtEdnGo
InChI InChI=1S/C12H15NO4/c1-7-8(2)17-12(16)11(7)13-9(5-14)3-4-10(13)6-15/h3-4,8,14-15H,5-6H2,1-2H3/t8-/m1/s1
InChIKey GQPHVVDGJWHSMR-MRVPVSSYSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fzo97MSa2GQ
Name (2R)-4-(2,5-dimethylolpyrrol-1-yl)-2,3-dimethyl-2H-furan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-7-8(2)17-12(16)11(7)13-9(5-14)3-4-10(13)6-15/h3-4,8,14-15H,5-6H2,1-2H3/t8-/m1/s1
InChIKey GQPHVVDGJWHSMR-MRVPVSSYSA-N
Molecular Weight 237.255 g/mol
SMILES OCc1[n](c(CO)cc1)C=1C(O[C@@](C1C)(C)[H])=O
SPLASH splash10-01q9-9310000000-e599c41753b3e73e0eca
Source of Spectrum X2-53-1614-1
Synonyms (2R)-4-[2,5-bis(hydroxymethyl)-1-pyrrolyl]-2,3-dimethyl-2H-furan-5-one (2R)-4-[2,5-bis(hydroxymethyl)pyrrol-1-yl]-2,3-dimethyl-2H-furan-5-one Funebradiol
Wiley ID 1603802