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sebacic acid, benzyl (1-methylheptyl) ester
SpectraBase Compound ID ExezRqkTQj8
InChI InChI=1S/C25H40O4/c1-3-4-5-11-16-22(2)29-25(27)20-15-9-7-6-8-14-19-24(26)28-21-23-17-12-10-13-18-23/h10,12-13,17-18,22H,3-9,11,14-16,19-21H2,1-2H3
InChIKey BXTLMSMYHDDRTK-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C25H40O4
Exact Mass 404.29266 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F4pefXK3Vgx
Name sebacic acid, benzyl (1-methylheptyl) ester
Source of Sample Hardesby Chemical Company, Inc., Dover, Ohio
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O4
InChI InChI=1S/C25H40O4/c1-3-4-5-11-16-22(2)29-25(27)20-15-9-7-6-8-14-19-24(26)28-21-23-17-12-10-13-18-23/h10,12-13,17-18,22H,3-9,11,14-16,19-21H2,1-2H3
InChIKey BXTLMSMYHDDRTK-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 6557M
Solvent CCl4