3-[3,4-Bis(acetyloxy)cyclohexyl]propanoic acid

SpectraBase Compound ID	6iMUEUvrpnu
InChI	InChI=1S/C13H20O6/c1-8(14)18-11-5-3-10(4-6-13(16)17)7-12(11)19-9(2)15/h10-12H,3-7H2,1-2H3,(H,16,17)
InChIKey	CGFJSBGQBUMSFE-UHFFFAOYSA-N Google Search
Mol Weight	272.3 g/mol
Molecular Formula	C13H20O6
Exact Mass	272.125988 g/mol

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SpectraBase Spectrum ID	A4usJdn449a
Name	3-[3,4-Bis(acetyloxy)cyclohexyl]propanoic acid
Alternate Name(s)	3-(3,4-diacetoxycyclohexyl)propanoic acid 3-(3,4-diacetoxycyclohexyl)propionic acid 3-(3,4-diacetyloxycyclohexyl)propanoic acid Cyclohexanepropanoic acid, 3,4-bis(acetyloxy)-
CAS Registry Number	77828-55-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H20O6
InChI	InChI=1S/C13H20O6/c1-8(14)18-11-5-3-10(4-6-13(16)17)7-12(11)19-9(2)15/h10-12H,3-7H2,1-2H3,(H,16,17)
InChIKey	CGFJSBGQBUMSFE-UHFFFAOYSA-N
Molecular Weight	272.297 g/mol
SMILES	OC(CCC1CC(C(CC1)OC(C)=O)OC(C)=O)=O
SPLASH	splash10-0006-9300000000-a5ee2512ff2c53899d25
Source of Spectrum	W5-0-0-0
Wiley ID	1275874