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Dimethyl triaconta-11,13,15,17,19-pentaene-dioate

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Dimethyl triaconta-11,13,15,17,19-pentaene-dioate
SpectraBase Compound ID ywTBO9Uxn4
InChI InChI=1S/C32H52O4/c1-35-31(33)29-27-25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32(34)36-2/h3-12H,13-30H2,1-2H3/b4-3+,7-5+,8-6+,11-9+,12-10+
InChIKey MTGCONCQFFIWHU-RZLSLBLSSA-N
Mol Weight 500.8 g/mol
Molecular Formula C32H52O4
Exact Mass 500.38656 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEefzFuN6B1
Name Dimethyl triaconta-11,13,15,17,19-pentaene-dioate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.386560150 u
Formula C32H52O4
InChI InChI=1S/C32H52O4/c1-35-31(33)29-27-25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32(34)36-2/h3-12H,13-30H2,1-2H3/b4-3+,7-5+,8-6+,11-9+,12-10+
InChIKey MTGCONCQFFIWHU-RZLSLBLSSA-N
Molecular Weight 500.764 g/mol
SMILES C(=O)(OC)CCCCCCCCC\C=C\C=C\C=C\C=C\C=C\CCCCCCCCCC(=O)OC