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1,11-bis(5-formyl-2,4-dimethylpyrrol-3-yl)undecane
SpectraBase Compound ID 4vNA72yMNT8
InChI InChI=1S/C25H38N2O2/c1-18-22(20(3)26-24(18)16-28)14-12-10-8-6-5-7-9-11-13-15-23-19(2)25(17-29)27-21(23)4/h16-17,26-27H,5-15H2,1-4H3
InChIKey XGFUGUJHZGUACG-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C25H38N2O2
Exact Mass 398.293328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CU7ujwrUF3d
Name 1,11-bis(5-formyl-2,4-dimethylpyrrol-3-yl)undecane
Alternate Name(s) 4-[11-(5-formyl-2,4-dimethyl-1H-pyrrol-3-yl)undecyl]-3,5-dimethyl-1H-pyrrole-2-carbaldehyde
CAS Registry Number 87280-97-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H38N2O2
InChI InChI=1S/C25H38N2O2/c1-18-22(20(3)26-24(18)16-28)14-12-10-8-6-5-7-9-11-13-15-23-19(2)25(17-29)27-21(23)4/h16-17,26-27H,5-15H2,1-4H3
InChIKey XGFUGUJHZGUACG-UHFFFAOYSA-N
Molecular Weight 398.591 g/mol
SMILES [nH]1c(c(CCCCCCCCCCCc2c([nH]c(c2C)C=O)C)c(c1C=O)C)C
SPLASH splash10-052r-0902000000-5bb01e71e2d025d5f326
Source of Spectrum J-53-1349-13
Wiley ID 1368615