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2,4-Octadienoic acid, 7-(1-ethoxyethoxy)-, methyl ester, [R*,R*-(E,E)]-(.+-.)-
SpectraBase Compound ID HFzZJp1wJzl
InChI InChI=1S/C13H22O4/c1-5-16-12(3)17-11(2)9-7-6-8-10-13(14)15-4/h6-8,10-12H,5,9H2,1-4H3/b7-6+,10-8+/t11-,12-/m1/s1
InChIKey UUTJJWSDOOBVJI-DBOSWYLRSA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID t5WEZ9CM5A
Name 2,4-Octadienoic acid, 7-(1-ethoxyethoxy)-, methyl ester, [R*,R*-(E,E)]-(.+-.)-
Alternate Name(s) Methyl (2E,4E,7R)-7-{[(1R)-1-ethoxyethyl]oxy}-2,4-octadienoate Methylester of (2E,4E)-7-(1'-ethoxyethoxy)-2,4-octadienoic acid
CAS Registry Number 79427-01-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-5-16-12(3)17-11(2)9-7-6-8-10-13(14)15-4/h6-8,10-12H,5,9H2,1-4H3/b7-6+,10-8+/t11-,12-/m1/s1
InChIKey UUTJJWSDOOBVJI-DBOSWYLRSA-N
Molecular Weight 242.315 g/mol
SMILES C(\C=C\C=C\C[C@](O[C@@](OCC)(C)[H])(C)[H])(=O)OC
SPLASH splash10-00dj-9100000000-d44452f2a9bb5269a2e5
Source of Spectrum H-64-1482-0
Wiley ID 1244925