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1,9-Di-n-propyltricyclo[7.2.2.0(1,9)]tridec-12-en-10,11-dione
SpectraBase Compound ID HSE8Fn6uYUI
InChI InChI=1S/C19H28O2/c1-3-10-18-12-13-19(11-4-2,17(21)16(18)20)15-9-7-5-6-8-14(15)18/h12-15H,3-11H2,1-2H3/t14-,15+,18-,19+
InChIKey WPFJYVZKBLQBEH-FDCRZUCXSA-N
Mol Weight 288.43 g/mol
Molecular Formula C19H28O2
Exact Mass 288.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GtHFrUIGMN2
Name 1,9-Di-n-propyltricyclo[7.2.2.0(1,9)]tridec-12-en-10,11-dione
Alternate Name(s) 1,9-Di-n-propyltricyclo[7.2.2.0(2,8)]tridec-12-en-10,11-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O2
InChI InChI=1S/C19H28O2/c1-3-10-18-12-13-19(11-4-2,17(21)16(18)20)15-9-7-5-6-8-14(15)18/h12-15H,3-11H2,1-2H3/t14-,15+,18-,19+
InChIKey WPFJYVZKBLQBEH-FDCRZUCXSA-N
Molecular Weight 288.431 g/mol
SMILES [C@@]12(C(C(=O)[C@]([C@]3([C@@]2(CCCCC3)[H])[H])(CCC)C=C1)=O)CCC
SPLASH splash10-001i-0980000000-100b5304c8bbc43bdfc9
Source of Spectrum QA-31-67-3
Wiley ID 860934