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METHYL-3-ACETOXYOCTADECANOATE

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METHYL-3-ACETOXYOCTADECANOATE
SpectraBase Compound ID KDzC3WiVhr1
InChI InChI=1S/C21H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(25-19(2)22)18-21(23)24-3/h20H,4-18H2,1-3H3
InChIKey XMPINKKEZYUKPI-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C21H40O4
Exact Mass 356.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HqhbvQKYWjH
Name 3-Acetoxy-octadecanoic acid, methyl ester
CAS Registry Number 2420-37-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H40O4
InChI InChI=1S/C21H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(25-19(2)22)18-21(23)24-3/h20H,4-18H2,1-3H3
InChIKey XMPINKKEZYUKPI-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference A.P. Tulloch, Org. Magn. Resonance 11, 109 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3