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2-Butanone, 4-(3,3-dimethyl-7-methyleneoxepan-2-ylidene)-
SpectraBase Compound ID Fy8jJuT3xMe
InChI InChI=1S/C13H20O2/c1-10(14)7-8-12-13(3,4)9-5-6-11(2)15-12/h8H,2,5-7,9H2,1,3-4H3/b12-8-
InChIKey SHEBBINZQFLIPI-WQLSENKSSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZSTdZNLXbT
Name 2-Butanone, 4-(3,3-dimethyl-7-methyleneoxepan-2-ylidene)-
Alternate Name(s) Oxepane, 2-butanone deriv. (4Z)-4-(3,3-dimethyl-7-methylene-2-oxepanylidene)-2-butanone 4-(7',7'-Dimethyl-3'-methyliden-2'-oxacycloheptylidene)-2-butanone
CAS Registry Number 102635-39-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-10(14)7-8-12-13(3,4)9-5-6-11(2)15-12/h8H,2,5-7,9H2,1,3-4H3/b12-8-
InChIKey SHEBBINZQFLIPI-WQLSENKSSA-N
Molecular Weight 208.301 g/mol
SMILES C1(O\C(C(CCC1)(C)C)=C\CC(=O)C)=C
SPLASH splash10-00kf-9300000000-c630eb5afeb9abb79124
Source of Spectrum H-68-1100-13
Wiley ID 1207230