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(RS)-6-[1'-Benzoyloxy-3'-(3'',4'',5''-trimethoxyphenyl)propyl]-2-methoxycyclohepta-2,4,6-trienone
SpectraBase Compound ID WjpSZr2VPS
InChI InChI=1S/C27H28O7/c1-30-23-12-8-11-20(17-21(23)28)22(34-27(29)19-9-6-5-7-10-19)14-13-18-15-24(31-2)26(33-4)25(16-18)32-3/h5-12,15-17,22H,13-14H2,1-4H3
InChIKey FVDUGWVTJKXDLJ-UHFFFAOYSA-N
Mol Weight 464.51 g/mol
Molecular Formula C27H28O7
Exact Mass 464.183503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15uZgCZAQOY
Name (RS)-6-[1'-Benzoyloxy-3'-(3'',4'',5''-trimethoxyphenyl)propyl]-2-methoxycyclohepta-2,4,6-trienone
Alternate Name(s) 1-(4-Methoxy-3-oxo-1,4,6-cycloheptatrien-1-yl)-3-(3,4,5-trimethoxyphenyl)propyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28O7
InChI InChI=1S/C27H28O7/c1-30-23-12-8-11-20(17-21(23)28)22(34-27(29)19-9-6-5-7-10-19)14-13-18-15-24(31-2)26(33-4)25(16-18)32-3/h5-12,15-17,22H,13-14H2,1-4H3
InChIKey FVDUGWVTJKXDLJ-UHFFFAOYSA-N
Molecular Weight 464.514 g/mol
SMILES C1=C(C(OC(=O)c2ccccc2)CCc2cc(OC)c(c(c2)OC)OC)C=CC=C(C1=O)OC
SPLASH splash10-0a59-2902100000-b844542f8d63166d7dfa
Source of Spectrum KC-0-2826-24
Wiley ID 780055