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7-Nonenal, 5,5-diacetyl-, (E)-

View entire compound with spectra: 1 MS (GC)

7-Nonenal, 5,5-diacetyl-, (E)-
SpectraBase Compound ID G47KTJyU0yd
InChI InChI=1S/C13H20O3/c1-4-5-8-13(11(2)15,12(3)16)9-6-7-10-14/h4-5,10H,6-9H2,1-3H3/b5-4+
InChIKey QRRDUFMEPCOSJO-SNAWJCMRSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8cLxEQVjAQ
Name 7-Nonenal, 5,5-diacetyl-, (E)-
Alternate Name(s) (7E)-5,5-diacetyl-7-nonenal 5,5-Diacetylnon-7-en-1-al
CAS Registry Number 87879-59-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-4-5-8-13(11(2)15,12(3)16)9-6-7-10-14/h4-5,10H,6-9H2,1-3H3/b5-4+
InChIKey QRRDUFMEPCOSJO-SNAWJCMRSA-N
Molecular Weight 224.300 g/mol
SMILES C(C(=O)C)(C(=O)C)(C\C=C\C)CCCC=O
SPLASH splash10-05ai-3900000000-132a81f5dcea8493f9a0
Source of Spectrum KC-1983-1933-0
Wiley ID 1225201