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2-(1-Oxododecyl)-5-methylpyrrole
SpectraBase Compound ID HI33AbbPx2l
InChI InChI=1S/C17H29NO/c1-3-4-5-6-7-8-9-10-11-12-17(19)16-13-15(2)14-18-16/h13-14,18H,3-12H2,1-2H3
InChIKey GSWHATSTCKVTNE-UHFFFAOYSA-N
Mol Weight 263.42 g/mol
Molecular Formula C17H29NO
Exact Mass 263.224915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K1Q7VTG0eGD
Name 2-(1-Oxododecyl)-5-methylpyrrole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.224914557 u
Formula C17H29NO
InChI InChI=1S/C17H29NO/c1-3-4-5-6-7-8-9-10-11-12-17(19)16-13-15(2)14-18-16/h13-14,18H,3-12H2,1-2H3
InChIKey GSWHATSTCKVTNE-UHFFFAOYSA-N
Molecular Weight 263.425 g/mol
SMILES C1(=CNC(=C1)C(CCCCCCCCCCC)=O)C