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(2S)-2-(4',4'-Dimethyl-3'-oxopentyl)-2-methylcyclopentan-1-one
SpectraBase Compound ID 58GEWgS7MIi
InChI InChI=1S/C13H22O2/c1-12(2,3)10(14)7-9-13(4)8-5-6-11(13)15/h5-9H2,1-4H3/t13-/m0/s1
InChIKey YGCBNLQEBHNLTA-ZDUSSCGKSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I42WTzVHRcD
Name (2S)-2-(4',4'-Dimethyl-3'-oxopentyl)-2-methylcyclopentan-1-one
Alternate Name(s) (S)-2-(4,4-dimethyl-3-oxopentyl)-2-methylcyclopentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-12(2,3)10(14)7-9-13(4)8-5-6-11(13)15/h5-9H2,1-4H3/t13-/m0/s1
InChIKey YGCBNLQEBHNLTA-ZDUSSCGKSA-N
Literature Reference DOI 10.1002/anie.201409591
Molecular Weight 210.317 g/mol
SMILES C(C)(C)(C(CC[C@@]1(CCCC1=O)C)=O)C
SPLASH splash10-0ufr-4900000000-1c95cf9e847c809af4dc
Source of Spectrum ACI-54-1960/SMS11-5f
Wiley ID 1761089