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(1R,2R,1'R,2'R)-1,1'-Bis{2,2-dimethyl-1,3-bis[(S)-1-(ethoxycarbonyl)ethoxycarbonyl]cyclopropane}
SpectraBase Compound ID HA1xU7QwLga
InChI InChI=1S/C34H50O16/c1-9-43-21(35)13-17-47-27(39)25-31(5,6)33(25,29(41)49-19-15-23(37)45-11-3)34(30(42)50-20-16-24(38)46-12-4)26(32(34,7)8)28(40)48-18-14-22(36)44-10-2/h25-26H,9-20H2,1-8H3/t25-,26?,33-,34-/m1/s1
InChIKey HDKKUJVHXSWDLZ-TZVOLEAJSA-N
Mol Weight 714.8 g/mol
Molecular Formula C34H50O16
Exact Mass 714.309886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3hz2XRONEf
Name (1R,2R,1'R,2'R)-1,1'-Bis{2,2-dimethyl-1,3-bis[(S)-1-(ethoxycarbonyl)ethoxycarbonyl]cyclopropane}
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H50O16
InChI InChI=1S/C34H50O16/c1-9-43-21(35)13-17-47-27(39)25-31(5,6)33(25,29(41)49-19-15-23(37)45-11-3)34(30(42)50-20-16-24(38)46-12-4)26(32(34,7)8)28(40)48-18-14-22(36)44-10-2/h25-26H,9-20H2,1-8H3/t25-,26?,33-,34-/m1/s1
InChIKey HDKKUJVHXSWDLZ-TZVOLEAJSA-N
Molecular Weight 714.758 g/mol
SMILES [C@]1([C@@]2(C(C)(C)C2C(=O)OCCC(=O)OCC)C(=O)OCCC(=O)OCC)(C(C)(C)[C@]1(C(=O)OCCC(=O)OCC)[H])C(=O)OCCC(=O)OCC
SPLASH splash10-014i-0000009500-120fd7e660eb264e40fd
Source of Spectrum QE-5-2842-3
Wiley ID 844449