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6.5'-Diacetyl-5,6'-(1,4-dioxobutadiyl)-anti-bis[bicyclo[2.2.1]hept-2-ene]
SpectraBase Compound ID 1WWhkDlBtle
InChI InChI=1S/C22H26O4/c1-11(23)19-13-3-5-15(9-13)21(19)17(25)7-8-18(26)22-16-6-4-14(10-16)20(22)12(2)24/h3-6,13-16,19-22H,7-10H2,1-2H3
InChIKey NZBLRQVGIJKFBM-UHFFFAOYSA-N
Mol Weight 354.45 g/mol
Molecular Formula C22H26O4
Exact Mass 354.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JTaA3crsgL
Name 6.5'-Diacetyl-5,6'-(1,4-dioxobutadiyl)-anti-bis[bicyclo[2.2.1]hept-2-ene]
Alternate Name(s) 6.5'-Diacetyl-5,6'-(1,4-dioxobutadiyl)-syn-bis[bicyclo[2.2.1]hept-2-ene] 1,4-bis(3-acetylbicyclo[2.2.1]hept-5-en-2-yl)-1,4-butanedione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O4
InChI InChI=1S/C22H26O4/c1-11(23)19-13-3-5-15(9-13)21(19)17(25)7-8-18(26)22-16-6-4-14(10-16)20(22)12(2)24/h3-6,13-16,19-22H,7-10H2,1-2H3
InChIKey NZBLRQVGIJKFBM-UHFFFAOYSA-N
Molecular Weight 354.446 g/mol
SMILES C12C(C(C(CCC(C3C4C=CC(C3C(=O)C)C4)=O)=O)C(C2)C=C1)C(=O)C
SPLASH splash10-0gb9-0096000000-cca56d58c800a0f1d5ca
Source of Spectrum QA-45-141-6
Wiley ID 862749