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Carbonic acid, monoamide, N-propyl-N-pentyl-, but-3-yn-1-yl ester
SpectraBase Compound ID LPbMAFlEp4
InChI InChI=1S/C13H23NO2/c1-4-7-9-11-14(10-6-3)13(15)16-12-8-5-2/h2H,4,6-12H2,1,3H3
InChIKey SWPQLBPOJQAZKJ-UHFFFAOYSA-N
Mol Weight 225.33 g/mol
Molecular Formula C13H23NO2
Exact Mass 225.172879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9yyhdRpbjSs
Name Carbonic acid, monoamide, N-propyl-N-pentyl-, but-3-yn-1-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 225.172878983 u
Formula C13H23NO2
InChI InChI=1S/C13H23NO2/c1-4-7-9-11-14(10-6-3)13(15)16-12-8-5-2/h2H,4,6-12H2,1,3H3
InChIKey SWPQLBPOJQAZKJ-UHFFFAOYSA-N
Molecular Weight 225.332 g/mol
SMILES C(=O)(OCCC#C)N(CCC)CCCCC