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2-Butenedioic acid, 2-[5-(2,2,5-trimethyl-4,6-dioxo-1,3-dioxan-5-yl)-1,3-hexadienyl]-, dimethyl ester, (Z,E,E)-
SpectraBase Compound ID 58zfbWLN0nB
InChI InChI=1S/C19H24O8/c1-12(19(4)16(22)26-18(2,3)27-17(19)23)9-7-8-10-13(15(21)25-6)11-14(20)24-5/h7-12H,1-6H3/b9-7+,10-8+,13-11-
InChIKey BPBYKVNXKLWRSH-NZHRBBRVSA-N
Mol Weight 380.39 g/mol
Molecular Formula C19H24O8
Exact Mass 380.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZ1TIK6mO6b
Name 2-Butenedioic acid, 2-[5-(2,2,5-trimethyl-4,6-dioxo-1,3-dioxan-5-yl)-1,3-hexadienyl]-, dimethyl ester, (Z,E,E)-
Alternate Name(s) Dimethyl (2Z)-2-[(1E,3E)-5-(2,2,5-trimethyl-4,6-dioxo-1,3-dioxan-5-yl)-1,3-hexadienyl]-2-butenedioate Methyl (Z,E)-3-carbomethoxy-9,9-dicarbo-cyclic isopropoxy-8-methyl-2,4,6-decatrienoate
CAS Registry Number 58838-36-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O8
InChI InChI=1S/C19H24O8/c1-12(19(4)16(22)26-18(2,3)27-17(19)23)9-7-8-10-13(15(21)25-6)11-14(20)24-5/h7-12H,1-6H3/b9-7+,10-8+,13-11-
InChIKey BPBYKVNXKLWRSH-NZHRBBRVSA-N
Molecular Weight 380.393 g/mol
SMILES C1(C(OC(OC1=O)(C)C)=O)(C(\C=C\C=C\C(=C\C(=O)OC)C(=O)OC)C)C
SPLASH splash10-052f-9200000000-081d7f172ba158a1aaf2
Source of Spectrum C-98-1211-0
Wiley ID 1359602