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3',4',7'-Trimethoxysalvianolic Acid C - Dimethyl Ester
SpectraBase Compound ID 8uCQFRWyS5I
InChI InChI=1S/C23H22O8/c1-26-15-9-7-14(12-17(15)28-3)21-20(23(25)30-5)19-13(8-11-18(24)29-4)6-10-16(27-2)22(19)31-21/h6-12H,1-5H3/b11-8+
InChIKey JGYXEBFNXCSZFA-DHZHZOJOSA-N
Mol Weight 426.42 g/mol
Molecular Formula C23H22O8
Exact Mass 426.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsHCuvCUNfQ
Name 3',4',7'-Trimethoxysalvianolic Acid C - Dimethyl Ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O8
InChI InChI=1S/C23H22O8/c1-26-15-9-7-14(12-17(15)28-3)21-20(23(25)30-5)19-13(8-11-18(24)29-4)6-10-16(27-2)22(19)31-21/h6-12H,1-5H3/b11-8+
InChIKey JGYXEBFNXCSZFA-DHZHZOJOSA-N
Molecular Weight 426.421 g/mol
SMILES c1(c(oc2c1c(\C=C\C(=O)OC)ccc2OC)-c1cc(OC)c(cc1)OC)C(=O)OC
SPLASH splash10-004i-0000900000-19366016f9c62aa70412
Source of Spectrum X2-51-149-2
Wiley ID 1602565