14-Oxabicyclo[11.2.1]hexadecane, propanedioic acid deriv.

SpectraBase Compound ID	33EU2TfR332
InChI	InChI=1S/C24H36O6/c1-17-7-5-8-18(15-25)9-6-10-19(16-29-23(27)14-22(26)28-4)21-13-20(12-11-17)24(2,3)30-21/h7,9,15,19-21H,5-6,8,10-14,16H2,1-4H3/b17-7-,18-9+/t19-,20+,21-/m0/s1
InChIKey	JQIIGGDLEVCWJY-YODUYBDXSA-N Google Search
Mol Weight	420.5 g/mol
Molecular Formula	C24H36O6
Exact Mass	420.251189 g/mol

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SpectraBase Spectrum ID	2h5uv5euiXy
Name	14-Oxabicyclo[11.2.1]hexadecane, propanedioic acid deriv.
Alternate Name(s)	Propanedioic acid, (8-formyl-4,15,15-trimethyl-14-oxabicyclo[11.2.1]hexadeca-4,8-dien-12-yl)methyl methyl ester, [1R-(1R,4Z,8E,12S,13S*)]- 1-{[(1R,12S,13S)-8-formyl-4,15,15-trimethyl-14-oxabicyclo[11.2.1]hexadeca-4,8-dien-12-yl]methyl} 3-methyl malonate 4,15,15-Trimethyl-8-formyl-12-[(methoxycarbonyl)acetoxymethyl]-16-oxatricylo[12.1.2]hexadeca-4,8-diene
CAS Registry Number	105608-42-2
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H36O6
InChI	InChI=1S/C24H36O6/c1-17-7-5-8-18(15-25)9-6-10-19(16-29-23(27)14-22(26)28-4)21-13-20(12-11-17)24(2,3)30-21/h7,9,15,19-21H,5-6,8,10-14,16H2,1-4H3/b17-7-,18-9+/t19-,20+,21-/m0/s1
InChIKey	JQIIGGDLEVCWJY-YODUYBDXSA-N
Molecular Weight	420.546 g/mol
SMILES	C1(O[C@@]2([C@@](CC\C=C/(CC\C=C/(CC[C@@]1(C2)[H])C)C=O)(COC(CC(=O)OC)=O)[H])[H])(C)C
SPLASH	splash10-008c-9301200000-e6cc841bf69542ad9f98
Source of Spectrum	B-39-1709-16
Wiley ID	1378010