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Monocerin
SpectraBase Compound ID JNrPC7gsdid
InChI InChI=1S/C16H20O6/c1-4-5-8-6-11-14(21-8)9-7-10(19-2)15(20-3)13(17)12(9)16(18)22-11/h4-5,7-8,11,14,16-18H,6H2,1-3H3/b5-4+/t8-,11+,14+,16?/m0/s1
InChIKey BNHJRWHLRRKMKP-CXECJNAQSA-N
Mol Weight 308.33 g/mol
Molecular Formula C16H20O6
Exact Mass 308.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3i6roeRfjof
Name Monocerin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O6
InChI InChI=1S/C16H20O6/c1-4-5-8-6-11-14(21-8)9-7-10(19-2)15(20-3)13(17)12(9)16(18)22-11/h4-5,7-8,11,14,16-18H,6H2,1-3H3/b5-4+/t8-,11+,14+,16?/m0/s1
InChIKey BNHJRWHLRRKMKP-CXECJNAQSA-N
Molecular Weight 308.330 g/mol
SMILES OC1O[C@@]2(C[C@@](O[C@@]2(c2c1c(c(c(c2)OC)OC)O)[H])(\C=C\C)[H])[H]
SPLASH splash10-0a4i-0069000000-55480cfb1de109b5a96f
Source of Spectrum F6-43-729-5
Synonyms (2R,3aR,9bR)-7,8-dimethoxy-2-[(1E)-1-propenyl]-3,3a,5,9b-tetrahydro-2H-furo[3,2-c][2]benzopyran-5,6-diol
Wiley ID 1550628