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Hierochins B

View entire compound with spectra: 1 MS (GC)

Hierochins B
SpectraBase Compound ID CPQHGSZxCEz
InChI InChI=1S/C21H24O6/c1-24-17-7-6-14(11-18(17)25-2)20-16(12-23)15-9-13(5-4-8-22)10-19(26-3)21(15)27-20/h4-7,9-11,16,20,22-23H,8,12H2,1-3H3/b5-4+/t16-,20+/m0/s1
InChIKey IATWXYMZKVGQLC-WXVIEYATSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YmSXptgSpL
Name Hierochins B
Alternate Name(s) (E)-3-[(2S,3R)-2-(3,4-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl]-2-propen-1-ol (E)-3-[(2S,3R)-2-(3,4-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl]prop-2-en-1-ol (E)-3-[(2S,3R)-2-(3,4-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-en-1-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-24-17-7-6-14(11-18(17)25-2)20-16(12-23)15-9-13(5-4-8-22)10-19(26-3)21(15)27-20/h4-7,9-11,16,20,22-23H,8,12H2,1-3H3/b5-4+/t16-,20+/m0/s1
InChIKey IATWXYMZKVGQLC-WXVIEYATSA-N
Molecular Weight 372.417 g/mol
SMILES OC[C@]1(c2c(c(cc(\C=C\CO)c2)OC)O[C@@]1(c1cc(OC)c(cc1)OC)[H])[H]
SPLASH splash10-0uk9-0009000000-672addf4386e96909407
Source of Spectrum O1-60-1792-2
Wiley ID 1592155