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METHYL-VIRENSATE
SpectraBase Compound ID 6752LoW7QlI
InChI InChI=1S/C19H16O8/c1-7-5-11(21)10(6-20)17-12(7)19(24)27-16-9(3)14(22)13(18(23)25-4)8(2)15(16)26-17/h5-6,21-22H,1-4H3
InChIKey HTAATVDZOHXHBE-UHFFFAOYSA-N
Mol Weight 372.33 g/mol
Molecular Formula C19H16O8
Exact Mass 372.084517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2qRANc3rW5
Name 11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 4-formyl-3,8-dihydroxy-1,6,9-trimethyl-11-oxo-, methyl ester
Alternate Name(s) Methyl 4-formyl-3,8-dihydroxy-1,6,9-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-7-carboxylate Granulatin Methyl virensate
CAS Registry Number 69306-81-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O8
InChI InChI=1S/C19H16O8/c1-7-5-11(21)10(6-20)17-12(7)19(24)27-16-9(3)14(22)13(18(23)25-4)8(2)15(16)26-17/h5-6,21-22H,1-4H3
InChIKey HTAATVDZOHXHBE-UHFFFAOYSA-N
Molecular Weight 372.329 g/mol
SMILES Oc1c(c(c2c(OC(c3c(c(c(cc3C)O)C=O)O2)=O)c1C)C)C(=O)OC
SPLASH splash10-00di-0089000000-54466656adb2092e2395
Source of Spectrum KC-1979-1657-0
Wiley ID 1355331