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MALONIC ACID, tert-BUTYL-, DI-(-)-MENTHYL ESTER
SpectraBase Compound ID JJxKKVzweFl
InChI InChI=1S/C21H36O4.2C3H8/c1-14-8-6-10-16(12-14)24-19(22)18(21(3,4)5)20(23)25-17-11-7-9-15(2)13-17;2*1-3-2/h14-18H,6-13H2,1-5H3;2*3H2,1-2H3
InChIKey SJSFZHITYXHVPW-UHFFFAOYSA-N
Mol Weight 440.71 g/mol
Molecular Formula C27H52O4
Exact Mass 440.38656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90Oq29p8UWw
Name MALONIC ACID, tert-BUTYL-, DI-(-)-MENTHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H48O4
InChI InChI=1S/C21H36O4.2C3H8/c1-14-8-6-10-16(12-14)24-19(22)18(21(3,4)5)20(23)25-17-11-7-9-15(2)13-17;2*1-3-2/h14-18H,6-13H2,1-5H3;2*3H2,1-2H3
InChIKey SJSFZHITYXHVPW-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 440.3852
SMILES C(C)C.C1CCC(OC(C(C(C)(C)C)C(OC2CC(C)CCC2)=O)=O)CC1C.CCC
SPLASH splash10-0019-9700000000-569a4128d3e0c3a4621a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany