(2E,4E,6E,12Z)-Tetradeca-2,4,6,12-tetraen-8,10-diynoic Acid - Isobutyl Amide - Optional[MS (GC)] - Spectrum

SpectraBase Compound ID	Gc5Ys0hVPyf
InChI	InChI=1S/C18H21NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h4-5,10-15,17H,16H2,1-3H3,(H,19,20)/b5-4-,11-10+,13-12+,15-14+
InChIKey	WPEQVXWZTNLDRM-PPMOTMRESA-N Google Search
Mol Weight	267.37 g/mol
Molecular Formula	C18H21NO
Exact Mass	267.162314 g/mol

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SpectraBase Spectrum ID	DFNiJ1QvHiu
Name	(2E,4E,6E,12Z)-Tetradeca-2,4,6,12-tetraen-8,10-diynoic Acid - Isobutyl Amide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H21NO
InChI	InChI=1S/C18H21NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h4-5,10-15,17H,16H2,1-3H3,(H,19,20)/b5-4-,11-10+,13-12+,15-14+
InChIKey	WPEQVXWZTNLDRM-PPMOTMRESA-N
Molecular Weight	267.372 g/mol
SMILES	N(C(\C=C\C=C\C=C\C#CC#C\C=C/C)=O)CC(C)C
SPLASH	splash10-0fr6-4910000000-bb78a53d6f50bc1d254d
Source of Spectrum	X2-50-1107-12
Synonyms	(2E,4E,6E,12Z)-N-isobutyl-2,4,6,12-tetradecatetraene-8,10-diynamide
Wiley ID	1602480