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2,7-Diacetoxy-1,3,6,8-tetrabenzyloxy-9-isopropyl-9H-xanthene
SpectraBase Compound ID JaRbm617euv
InChI InChI=1S/C48H44O9/c1-31(2)42-43-38(25-40(51-27-34-17-9-5-10-18-34)45(55-32(3)49)47(43)53-29-36-21-13-7-14-22-36)57-39-26-41(52-28-35-19-11-6-12-20-35)46(56-33(4)50)48(44(39)42)54-30-37-23-15-8-16-24-37/h5-26,31,42H,27-30H2,1-4H3
InChIKey BNOIUSWFXXTCLP-UHFFFAOYSA-N
Mol Weight 764.9 g/mol
Molecular Formula C48H44O9
Exact Mass 764.298533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IExDNAwl1fI
Name 2,7-Diacetoxy-1,3,6,8-tetrabenzyloxy-9-isopropyl-9H-xanthene
Alternate Name(s) 7-(acetyloxy)-1,3,6,8-tetrakis(benzyloxy)-9-isopropyl-9H-xanthen-2-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H44O9
InChI InChI=1S/C48H44O9/c1-31(2)42-43-38(25-40(51-27-34-17-9-5-10-18-34)45(55-32(3)49)47(43)53-29-36-21-13-7-14-22-36)57-39-26-41(52-28-35-19-11-6-12-20-35)46(56-33(4)50)48(44(39)42)54-30-37-23-15-8-16-24-37/h5-26,31,42H,27-30H2,1-4H3
InChIKey BNOIUSWFXXTCLP-UHFFFAOYSA-N
Molecular Weight 764.871 g/mol
SMILES c12c(c(OC(=O)C)c(cc2Oc2cc(OCc3ccccc3)c(c(c2C1C(C)C)OCc1ccccc1)OC(=O)C)OCc1ccccc1)OCc1ccccc1
SPLASH splash10-006x-9000000500-d495c6d3b66d36660719
Source of Spectrum SO-0-695-12
Wiley ID 873006