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1,2-Bis[2-methyl-3-tert-butoxycarbonylpyrrole]cyclohexane
SpectraBase Compound ID AgsI8rGzeKZ
InChI InChI=1S/C26H38N2O4/c1-17-19(23(29)31-25(3,4)5)13-15-27(17)21-11-9-10-12-22(21)28-16-14-20(18(28)2)24(30)32-26(6,7)8/h13-16,21-22H,9-12H2,1-8H3/t21-,22-/m1/s1
InChIKey KPONWCOBVUCBJB-FGZHOGPDSA-N
Mol Weight 442.6 g/mol
Molecular Formula C26H38N2O4
Exact Mass 442.283158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KklM91vmno6
Name 1,2-Bis[2-methyl-3-tert-butoxycarbonylpyrrole]cyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38N2O4
InChI InChI=1S/C26H38N2O4/c1-17-19(23(29)31-25(3,4)5)13-15-27(17)21-11-9-10-12-22(21)28-16-14-20(18(28)2)24(30)32-26(6,7)8/h13-16,21-22H,9-12H2,1-8H3/t21-,22-/m1/s1
InChIKey KPONWCOBVUCBJB-FGZHOGPDSA-N
Molecular Weight 442.600 g/mol
SMILES c1(c([n]([C@]2([C@]([n]3c(c(C(OC(C)(C)C)=O)cc3)C)(CCCC2)[H])[H])cc1)C)C(OC(C)(C)C)=O
SPLASH splash10-004i-0019000000-169717ba8b50a10259f0
Source of Spectrum CV-2004-921-21
Wiley ID 1611241