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3-(Decyloxy)-7-carbethoxy-9-oxo-9H-xanthene-4-propanoic Acid Ethyl Ester
SpectraBase Compound ID 9amD8A5Dkdz
InChI InChI=1S/C31H40O7/c1-4-7-8-9-10-11-12-13-20-37-26-18-15-24-29(33)25-21-22(31(34)36-6-3)14-17-27(25)38-30(24)23(26)16-19-28(32)35-5-2/h14-15,17-18,21H,4-13,16,19-20H2,1-3H3
InChIKey FEFIAEFPFBWLOZ-UHFFFAOYSA-N
Mol Weight 524.7 g/mol
Molecular Formula C31H40O7
Exact Mass 524.277404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dk9q1cCtbIM
Name 3-(Decyloxy)-7-carbethoxy-9-oxo-9H-xanthene-4-propanoic Acid Ethyl Ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H40O7
InChI InChI=1S/C31H40O7/c1-4-7-8-9-10-11-12-13-20-37-26-18-15-24-29(33)25-21-22(31(34)36-6-3)14-17-27(25)38-30(24)23(26)16-19-28(32)35-5-2/h14-15,17-18,21H,4-13,16,19-20H2,1-3H3
InChIKey FEFIAEFPFBWLOZ-UHFFFAOYSA-N
Molecular Weight 524.654 g/mol
SMILES c12c(C(=O)c3c(O2)ccc(C(=O)OCC)c3)ccc(c1CCC(=O)OCC)OCCCCCCCCCC
SPLASH splash10-0079-0209070000-a7472fa2078edb448bdd
Source of Spectrum E1-36-1732-24
Synonyms Ethyl 6-(decyloxy)-5-(3-ethoxy-3-oxopropyl)-9-oxo-9H-xanthene-2-carboxylate 6-decoxy-5-(3-ethoxy-3-oxopropyl)-9-oxo-2-xanthenecarboxylic acid ethyl ester Ethyl 6-decoxy-5-(3-ethoxy-3-oxopropyl)-9-oxoxanthene-2-carboxylate Ethyl 6-decoxy-5-(3-ethoxy-3-oxo-propyl)-9-oxo-xanthene-2-carboxylate Ethyl 6-decoxy-5-(3-ethoxy-3-oxidanylidene-propyl)-9-oxidanylidene-xanthene-2-carboxylate
Wiley ID 1574642