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rel-(4R,5S,6S)-4,8,8-Trimethyl-6-(1-oxopropyl)spiro[4.4]nonan-1-one
SpectraBase Compound ID HOTYy6Y1Dxs
InChI InChI=1S/C15H24O2/c1-5-12(16)11-8-14(3,4)9-15(11)10(2)6-7-13(15)17/h10-11H,5-9H2,1-4H3/t10-,11-,15+/m0/s1
InChIKey DFLJKQBPJGIOMZ-ZIBATOQPSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DuNGqsn8V
Name rel-(4R,5S,6S)-4,8,8-Trimethyl-6-(1-oxopropyl)spiro[4.4]nonan-1-one
Alternate Name(s) (4R,5S,6S)-4,8,8-trimethyl-6-propionylspiro[4.4]nonan-1-one (4S,5R,6R)-4,8,8-Trimethyl-6-propionyl-spiro[4.4]nonan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-5-12(16)11-8-14(3,4)9-15(11)10(2)6-7-13(15)17/h10-11H,5-9H2,1-4H3/t10-,11-,15+/m0/s1
InChIKey DFLJKQBPJGIOMZ-ZIBATOQPSA-N
Molecular Weight 236.355 g/mol
SMILES [C@]12([C@@](CC(C2)(C)C)(C(=O)CC)[H])C(CC[C@@]1(C)[H])=O
SPLASH splash10-0a4j-5900000000-e460139b84fc8dad6bc3
Source of Spectrum J-59-108-13
Wiley ID 1238821