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2,5-Bis(5-t-Butylcarbonyl-3,4-diethyl-2-pyrrolylmethyl)-3,4-diethyl-1H-pyrrole
SpectraBase Compound ID 9MGFYi91Fnb
InChI InChI=1S/C36H55N3O4/c1-13-21-22(14-2)28(20-30-24(16-4)26(18-6)32(39-30)34(41)43-36(10,11)12)37-27(21)19-29-23(15-3)25(17-5)31(38-29)33(40)42-35(7,8)9/h37-39H,13-20H2,1-12H3
InChIKey VAAHFWBXWCDHKO-UHFFFAOYSA-N
Mol Weight 593.9 g/mol
Molecular Formula C36H55N3O4
Exact Mass 593.419257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7DvdENPCnTN
Name 2,5-Bis(5-t-Butylcarbonyl-3,4-diethyl-2-pyrrolylmethyl)-3,4-diethyl-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H55N3O4
InChI InChI=1S/C36H55N3O4/c1-13-21-22(14-2)28(20-30-24(16-4)26(18-6)32(39-30)34(41)43-36(10,11)12)37-27(21)19-29-23(15-3)25(17-5)31(38-29)33(40)42-35(7,8)9/h37-39H,13-20H2,1-12H3
InChIKey VAAHFWBXWCDHKO-UHFFFAOYSA-N
Molecular Weight 593.853 g/mol
SMILES [nH]1c(c(c(c1Cc1c(c(c(Cc2c(c(c([nH]2)C(OC(C)(C)C)=O)CC)CC)[nH]1)CC)CC)CC)CC)C(OC(C)(C)C)=O
SPLASH splash10-005l-0920350000-a69b9bf01671bc603841
Source of Spectrum SO-0-2100-1
Synonyms 2,5-Bis(5-t-Butoxycarbonyl-3,4-diethyl-2-pyrrolylmethyl)-3,4-diethyl-1H-pyrrole
Wiley ID 877208