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1-O-methyl-ohioensin

View entire compound with spectra: 1 MS (GC)

1-O-methyl-ohioensin
SpectraBase Compound ID JyY2nsRFZOA
InChI InChI=1S/C25H20O5/c1-28-18-11-19(29-2)23-20-13(7-5-8-15(20)26)25-21-14(10-16(27)22(18)24(21)23)12-6-3-4-9-17(12)30-25/h3-9,11,14,21,25-26H,10H2,1-2H3
InChIKey RAHLNYQUSMLHPY-UHFFFAOYSA-N
Mol Weight 400.43 g/mol
Molecular Formula C25H20O5
Exact Mass 400.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6a8vkHkj6LT
Name 1-O-methyl-ohioensin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20O5
InChI InChI=1S/C25H20O5/c1-28-18-11-19(29-2)23-20-13(7-5-8-15(20)26)25-21-14(10-16(27)22(18)24(21)23)12-6-3-4-9-17(12)30-25/h3-9,11,14,21,25-26H,10H2,1-2H3
InChIKey RAHLNYQUSMLHPY-UHFFFAOYSA-N
Molecular Weight 400.430 g/mol
SMILES Oc1c2-c3c4C5C(c2ccc1)Oc1c(C5CC(c4c(cc3OC)OC)=O)cccc1
SPLASH splash10-0ue9-0029600000-d5d59f97def6a712a067
Source of Spectrum X2-57-39-6
Wiley ID 1605313