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(2-isopropyl-5-methyl-cyclohexyl) 3-oxobutanoate
SpectraBase Compound ID ET5PrZMPa40
InChI InChI=1S/C14H24O3/c1-9(2)12-6-5-10(3)7-13(12)17-14(16)8-11(4)15/h9-10,12-13H,5-8H2,1-4H3
InChIKey QSVQIPXQOCAWHP-UHFFFAOYSA-N
Mol Weight 240.34 g/mol
Molecular Formula C14H24O3
Exact Mass 240.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GMXnCIIrWo
Name (2-isopropyl-5-methyl-cyclohexyl) 3-oxobutanoate
CAS Registry Number 97403-74-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O3
InChI InChI=1S/C14H24O3/c1-9(2)12-6-5-10(3)7-13(12)17-14(16)8-11(4)15/h9-10,12-13H,5-8H2,1-4H3
InChIKey QSVQIPXQOCAWHP-UHFFFAOYSA-N
Molecular Weight 240.343 g/mol
SMILES C1(OC(CC(=O)C)=O)C(CCC(C1)C)C(C)C
SPLASH splash10-000t-9200000000-aa2241e885f2f2bbefa1
Source of Spectrum F-53-17389-4
Synonyms (5-methyl-2-propan-2-yl-cyclohexyl) 3-oxidanylidenebutanoate (5-methyl-2-propan-2-ylcyclohexyl) 3-oxobutanoate 3-ketobutyric acid (2-isopropyl-5-methyl-cyclohexyl) ester 3-Oxobutanoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester
Wiley ID 804836