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rac-1,1'-Bis[2,2-dimethyl-1,3-bis[2-(methoxycarbonyl)-2,2-dimethylethoxycarbonyl]cyclopropane]
SpectraBase Compound ID 5oA76pBrsO7
InChI InChI=1S/C38H58O16/c1-31(2,25(41)47-13)17-51-23(39)21-35(9,10)37(21,29(45)53-19-33(5,6)27(43)49-15)38(30(46)54-20-34(7,8)28(44)50-16)22(36(38,11)12)24(40)52-18-32(3,4)26(42)48-14/h21-22H,17-20H2,1-16H3/t21-,22-,37-,38-/m1/s1
InChIKey JGINKHKRGFETNY-CMDZOBNWSA-N
Mol Weight 770.9 g/mol
Molecular Formula C38H58O16
Exact Mass 770.372486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G4lHgld1Jsl
Name rac-1,1'-Bis[2,2-dimethyl-1,3-bis[2-(methoxycarbonyl)-2,2-dimethylethoxycarbonyl]cyclopropane]
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Formula C38H58O16
InChI InChI=1S/C38H58O16/c1-31(2,25(41)47-13)17-51-23(39)21-35(9,10)37(21,29(45)53-19-33(5,6)27(43)49-15)38(30(46)54-20-34(7,8)28(44)50-16)22(36(38,11)12)24(40)52-18-32(3,4)26(42)48-14/h21-22H,17-20H2,1-16H3/t21-,22-,37-,38-/m1/s1
InChIKey JGINKHKRGFETNY-CMDZOBNWSA-N
Molecular Weight 770.866 g/mol
SMILES [C@]1([C@@]2(C(C)(C)[C@]2(C(OCC(C(=O)OC)(C)C)=O)[H])C(OCC(C(=O)OC)(C)C)=O)(C(C)(C)[C@]1(C(OCC(C(=O)OC)(C)C)=O)[H])C(OCC(C(=O)OC)(C)C)=O
SPLASH splash10-00di-0505023900-ea86e61d48679ace198a
Source of Spectrum QE-5-2842-3
Wiley ID 844450