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(Z,Z)-1,6-Diacetoxy-1,6-dicyano-1,5-hexadiene
SpectraBase Compound ID BGYnzjr6lZs
InChI InChI=1S/C12H12N2O4/c1-9(15)17-11(7-13)5-3-4-6-12(8-14)18-10(2)16/h5-6H,3-4H2,1-2H3/b11-5-,12-6-
InChIKey IYFKNVDUILCHIO-CBIKUMSCSA-N
Mol Weight 248.24 g/mol
Molecular Formula C12H12N2O4
Exact Mass 248.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FNob52MNZo
Name (Z,Z)-1,6-Diacetoxy-1,6-dicyano-1,5-hexadiene
CAS Registry Number 139131-45-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O4
InChI InChI=1S/C12H12N2O4/c1-9(15)17-11(7-13)5-3-4-6-12(8-14)18-10(2)16/h5-6H,3-4H2,1-2H3/b11-5-,12-6-
InChIKey IYFKNVDUILCHIO-CBIKUMSCSA-N
Literature Reference DOI 10.1021/jo00034a015
Molecular Weight 248.238 g/mol
SMILES C(#N)\C(OC(=O)C)=C\CC\C=C\(C#N)OC(=O)C
SPLASH splash10-0006-9000000000-f346c106c33603e8815e
Source of Spectrum J-57-2265-8
Wiley ID 1250772