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Malonic acid, di-(-)-menthyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Malonic acid, di-(-)-menthyl ester
SpectraBase Compound ID Gx5uLbK6xQO
InChI InChI=1S/C17H28O4.2C3H8/c1-12-5-3-7-14(9-12)20-16(18)11-17(19)21-15-8-4-6-13(2)10-15;2*1-3-2/h12-15H,3-11H2,1-2H3;2*3H2,1-2H3
InChIKey AVHOIRALQIRCLE-UHFFFAOYSA-N
Mol Weight 384.6 g/mol
Molecular Formula C23H44O4
Exact Mass 384.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID qinP2sBlAV
Name Malonic acid, di-(-)-menthyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.323959893 u
Formula C23H44O4
InChI InChI=1S/C17H28O4.2C3H8/c1-12-5-3-7-14(9-12)20-16(18)11-17(19)21-15-8-4-6-13(2)10-15;2*1-3-2/h12-15H,3-11H2,1-2H3;2*3H2,1-2H3
InChIKey AVHOIRALQIRCLE-UHFFFAOYSA-N
Molecular Weight 384.601 g/mol
Nominal Mass 384 u
SMILES C(C)C.CC1CCCC(C1)OC(=O)CC(=O)OC1CCCC(C)C1.C(C)C