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4-[1-Methyl-7-(2-dimethoxy)ethyl-5-oxocyclononen-6-ylmethyl]-1-methyl-7-(2-dimethoxy)ethyl-6-methylene-5-oxocyclononene
SpectraBase Compound ID 5il5HJR06Sz
InChI InChI=1S/C30H48O6/c1-20-9-8-10-27(31)26(24(15-12-20)19-29(35-6)36-7)17-25-16-13-21(2)11-14-23(22(3)30(25)32)18-28(33-4)34-5/h9,13,23-26,28-29H,3,8,10-12,14-19H2,1-2,4-7H3/b20-9-,21-13-
InChIKey DNSMEQNSBKPSMC-HEHRJAQHSA-N
Mol Weight 504.7 g/mol
Molecular Formula C30H48O6
Exact Mass 504.345089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37fR3m4aNU
Name 4-[1-Methyl-7-(2-dimethoxy)ethyl-5-oxocyclononen-6-ylmethyl]-1-methyl-7-(2-dimethoxy)ethyl-6-methylene-5-oxocyclononene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H48O6
InChI InChI=1S/C30H48O6/c1-20-9-8-10-27(31)26(24(15-12-20)19-29(35-6)36-7)17-25-16-13-21(2)11-14-23(22(3)30(25)32)18-28(33-4)34-5/h9,13,23-26,28-29H,3,8,10-12,14-19H2,1-2,4-7H3/b20-9-,21-13-
InChIKey DNSMEQNSBKPSMC-HEHRJAQHSA-N
Molecular Weight 504.708 g/mol
SMILES C1(C(C(CC2C(CC(OC)OC)CC\C(C)=C/CCC2=O)C\C=C/(CCC1CC(OC)OC)C)=O)=C
SPLASH splash10-0h6r-2951200000-645f33bb2a5b6af14ac1
Source of Spectrum AT-36-4982-11
Synonyms 8-(1,1-dimethoxyethyl)-2-{[2-(1,1-dimethoxyethyl)-5-methyl-9-oxo-5-cyclononen-1-yl]methyl}-5-methyl-9-methylene-4-cyclononen-1-one
Wiley ID 853171