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2,4,10,12-Cyclotridecatetraene-6,8-diyn-1-one, 2-ethyl-5,10-dimethyl-, oxime, (E,E,E,Z,Z)-
SpectraBase Compound ID 2DyYCFATeoU
InChI InChI=1S/C17H17NO/c1-4-16-13-12-15(3)9-6-5-8-14(2)10-7-11-17(16)18-19/h7,10-13,19H,4H2,1-3H3/b11-7-,14-10-,15-12-,16-13-,18-17-
InChIKey ZMIPLIINHASCIM-SIKJKKDLSA-N
Mol Weight 251.33 g/mol
Molecular Formula C17H17NO
Exact Mass 251.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vK4PXm35b2
Name 2,4,10,12-Cyclotridecatetraene-6,8-diyn-1-one, 2-ethyl-5,10-dimethyl-, oxime, (E,E,E,Z,Z)-
CAS Registry Number 104526-22-9
Comments Less than 3 mono-isotopic peaks
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Formula C17H17NO
InChI InChI=1S/C17H17NO/c1-4-16-13-12-15(3)9-6-5-8-14(2)10-7-11-17(16)18-19/h7,10-13,19H,4H2,1-3H3/b11-7-,14-10-,15-12-,16-13-,18-17-
InChIKey ZMIPLIINHASCIM-SIKJKKDLSA-N
Molecular Weight 251.329 g/mol
SMILES O\N=C/1\C(=C/C=C\(C#CC#C\C(=C/C=C\1)C)C)CC
SPLASH splash10-0udi-0090000000-6414135e3d2ffa3c9df7
Source of Spectrum AJ-59-1797-11
Synonyms (1Z)-2-ethyl-5,10-dimethyl-2,4,10,12-cyclotridecatetraene-6,8-diyn-1-one oxime 2-Ethyl-1-hydroxyimino-5,10-dimethylcyclotrideca-2,4,10,12-tetraene-6,8-diyne
Wiley ID 1254803