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syn-5,6,15,16-Tetrakis(methoxycarbonyl)-4,7,14,17-tetraacetoxy[2.2](1,4)phthalazinophane
SpectraBase Compound ID 5GkgguTPsE7
InChI InChI=1S/C40H36O16/c1-17(41)53-33-25-21-9-10-22(26(25)34(54-18(2)42)30(38(46)50-6)29(33)37(45)49-5)15-16-24-12-11-23(14-13-21)27-28(24)36(56-20(4)44)32(40(48)52-8)31(39(47)51-7)35(27)55-19(3)43/h9-12H,13-16H2,1-8H3
InChIKey RVSVVVIWUHUVKJ-UHFFFAOYSA-N
Mol Weight 772.7 g/mol
Molecular Formula C40H36O16
Exact Mass 772.200335 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7DZZ6Akgklt
Name syn-5,6,15,16-Tetrakis(methoxycarbonyl)-4,7,14,17-tetraacetoxy[2.2](1,4)phthalazinophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H36O16
InChI InChI=1S/C40H36O16/c1-17(41)53-33-25-21-9-10-22(26(25)34(54-18(2)42)30(38(46)50-6)29(33)37(45)49-5)15-16-24-12-11-23(14-13-21)27-28(24)36(56-20(4)44)32(40(48)52-8)31(39(47)51-7)35(27)55-19(3)43/h9-12H,13-16H2,1-8H3
InChIKey RVSVVVIWUHUVKJ-UHFFFAOYSA-N
Molecular Weight 772.712 g/mol
SMILES c1(c(c(OC(=O)C)c2c(c1OC(=O)C)c1ccc2CCc2c3c(c(C(=O)OC)c(c(c3c(CC1)cc2)OC(=O)C)C(=O)OC)OC(=O)C)C(=O)OC)C(=O)OC
SPLASH splash10-06y9-0215000900-c8809177843e84038418
Source of Spectrum KC-1-760-12
Wiley ID 1577674