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(+-)-3,3-Bis(ethoxycarbonyl)-6-(3,5-dimethyl-4-hydroxyphenyl)-1-methylenecycloheptane
SpectraBase Compound ID CWOwBtwMLNv
InChI InChI=1S/C22H30O5/c1-6-26-20(24)22(21(25)27-7-2)9-8-17(10-14(3)13-22)18-11-15(4)19(23)16(5)12-18/h11-12,17,23H,3,6-10,13H2,1-2,4-5H3
InChIKey WZMZTVLIWZGXKH-UHFFFAOYSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Z4jsAcGSBP
Name (+-)-3,3-Bis(ethoxycarbonyl)-6-(3,5-dimethyl-4-hydroxyphenyl)-1-methylenecycloheptane
Alternate Name(s) Diethyl 5-(4-hydroxy-3,5-dimethylphenyl)-3-methylene-1,1-cycloheptanedicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-6-26-20(24)22(21(25)27-7-2)9-8-17(10-14(3)13-22)18-11-15(4)19(23)16(5)12-18/h11-12,17,23H,3,6-10,13H2,1-2,4-5H3
InChIKey WZMZTVLIWZGXKH-UHFFFAOYSA-N
Molecular Weight 374.477 g/mol
SMILES Oc1c(cc(C2CCC(C(=O)OCC)(C(=O)OCC)CC(C2)=C)cc1C)C
SPLASH splash10-03k9-0901000000-42f4b8f2e4f787793423
Source of Spectrum J-59-6336-64
Wiley ID 1356773