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1,2,3,4,5,6,7,8-OCTAHYDRO-2,2,3,3,6,6,7,7-OCTA-(ETHOXYCARBONYL)-ANTHRACENE
SpectraBase Compound ID KsyLW4l39wJ
InChI InChI=1S/C38H50O16/c1-9-47-27(39)35(28(40)48-10-2)19-23-17-25-21-37(31(43)51-13-5,32(44)52-14-6)38(33(45)53-15-7,34(46)54-16-8)22-26(25)18-24(23)20-36(35,29(41)49-11-3)30(42)50-12-4/h17-18H,9-16,19-22H2,1-8H3
InChIKey GJCVQACMZOUKMP-UHFFFAOYSA-N
Mol Weight 762.8 g/mol
Molecular Formula C38H50O16
Exact Mass 762.309886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBScQWBezDr
Name 1,2,3,4,5,6,7,8-octahydro-2,2,3,3,6,6,7,7,-octakis(ethoxycarbonyl) anthracene
Alternate Name(s) octaethyl 5,8-dihydro-2,2,3,3,6,6,7,7(1H,4H)-anthraceneoctacarboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H50O16
InChI InChI=1S/C38H50O16/c1-9-47-27(39)35(28(40)48-10-2)19-23-17-25-21-37(31(43)51-13-5,32(44)52-14-6)38(33(45)53-15-7,34(46)54-16-8)22-26(25)18-24(23)20-36(35,29(41)49-11-3)30(42)50-12-4/h17-18H,9-16,19-22H2,1-8H3
InChIKey GJCVQACMZOUKMP-UHFFFAOYSA-N
Molecular Weight 762.802 g/mol
SMILES C1(C(Cc2c(C1)cc1CC(C(=O)OCC)(C(=O)OCC)C(Cc1c2)(C(=O)OCC)C(=O)OCC)(C(=O)OCC)C(=O)OCC)(C(=O)OCC)C(=O)OCC
SPLASH splash10-004i-0900000000-9ef943b200b10f949417
Source of Spectrum AH-123-131-1
Wiley ID 1416553