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(E)-4-Acetoxyundec-2-enal
SpectraBase Compound ID AATCxn0PXOJ
InChI InChI=1S/C13H22O3/c1-3-4-5-6-7-9-13(10-8-11-14)16-12(2)15/h8,10-11,13H,3-7,9H2,1-2H3/b10-8+
InChIKey GFOXHOVQQZOOMH-CSKARUKUSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I6zlb7snFJu
Name (E)-4-Acetoxyundec-2-enal
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-3-4-5-6-7-9-13(10-8-11-14)16-12(2)15/h8,10-11,13H,3-7,9H2,1-2H3/b10-8+
InChIKey GFOXHOVQQZOOMH-CSKARUKUSA-N
Molecular Weight 226.316 g/mol
SMILES C(=O)(OC(\C=C\C=O)CCCCCCC)C
SPLASH splash10-0a4i-9000000000-5344c2ef20b120961d69
Source of Spectrum J-58-5002-4
Synonyms (2E)-1-heptyl-4-oxo-2-butenyl acetate
Wiley ID 1227644