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(+)-Phillygenin

View entire compound with spectra: 1 MS (GC)

(+)-Phillygenin
SpectraBase Compound ID IUsp3rP6aIT
InChI InChI=1S/C21H24O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-26-20(14(15)10-27-21)12-4-6-16(22)18(8-12)24-2/h4-9,14-15,20-22H,10-11H2,1-3H3/t14-,15-,20+,21+/m1/s1
InChIKey CPJKKWDCUOOTEW-RPQNVMPDSA-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 4RTZhtnPWK
Name (+)-Phillygenin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-26-20(14(15)10-27-21)12-4-6-16(22)18(8-12)24-2/h4-9,14-15,20-22H,10-11H2,1-3H3/t14-,15-,20+,21+/m1/s1
InChIKey CPJKKWDCUOOTEW-RPQNVMPDSA-N
Molecular Weight 372.417 g/mol
SMILES Oc1ccc([C@]2([C@]3([C@]([C@](c4cc(OC)c(cc4)OC)(OC3)[H])(CO2)[H])[H])[H])cc1OC
SPLASH splash10-0fk9-0905000000-ac61017e55ddfeaed674
Source of Spectrum QA-45-776-8
Wiley ID 862897