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Dicyclohexylester of methyl-D3-malonic acid
SpectraBase Compound ID DzK9YTQYA81
InChI InChI=1S/C16H26O4/c1-12(15(17)19-13-8-4-2-5-9-13)16(18)20-14-10-6-3-7-11-14/h12-14H,2-11H2,1H3/i1D3
InChIKey WSHAHKVOVQSCNI-FIBGUPNXSA-N
Mol Weight 285.4 g/mol
Molecular Formula C16H232D3O4
Exact Mass 285.20194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kx2YbgQTcjN
Name Dicyclohexylester of methyl-D3-malonic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23D3O4
InChI InChI=1S/C16H26O4/c1-12(15(17)19-13-8-4-2-5-9-13)16(18)20-14-10-6-3-7-11-14/h12-14H,2-11H2,1H3/i1D3
InChIKey WSHAHKVOVQSCNI-FIBGUPNXSA-N
Molecular Weight 285.398 g/mol
SMILES C(C(C(OC1CCCCC1)=O)C([2D])([2D])[2D])(OC1CCCCC1)=O
SPLASH splash10-05fr-9800000000-fdb82e8b6655bb8746cd
Source of Spectrum GC-12-122-1
Wiley ID 1285998