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Ethyl 2-propionyl-4-isopropyl-4,8,8-trimethyl-1,2,3,4,5,6,7,8-octahtdronaphtalene-2-carboxylate
SpectraBase Compound ID 9hNdytbsRxA
InChI InChI=1S/C22H36O3/c1-8-18(23)22(19(24)25-9-2)13-17-16(11-10-12-20(17,5)6)21(7,14-22)15(3)4/h15H,8-14H2,1-7H3
InChIKey PAWOFYSRTHWWQP-UHFFFAOYSA-N
Mol Weight 348.5 g/mol
Molecular Formula C22H36O3
Exact Mass 348.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZziCx5JUK
Name Ethyl 2-propionyl-4-isopropyl-4,8,8-trimethyl-1,2,3,4,5,6,7,8-octahtdronaphtalene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O3
InChI InChI=1S/C22H36O3/c1-8-18(23)22(19(24)25-9-2)13-17-16(11-10-12-20(17,5)6)21(7,14-22)15(3)4/h15H,8-14H2,1-7H3
InChIKey PAWOFYSRTHWWQP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201028f
Molecular Weight 348.527 g/mol
SMILES C1(C)(C=2CC(C(=O)OCC)(C(=O)CC)CC(C)(C2CCC1)C(C)C)C
SPLASH splash10-0a4j-6191000000-fa52ad38d64002a51cd1
Source of Spectrum A1-13-3320/SMS22-4b
Synonyms Ethyl 4-isopropyl-4,8,8-trimethyl-2-propionyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-carboxylate
Wiley ID 1753260