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3-Hexanone, 2,2-dimethyl-5-(1-methylcyclopropyl)-
SpectraBase Compound ID 6qG4ctSeHzJ
InChI InChI=1S/C12H22O/c1-9(12(5)6-7-12)8-10(13)11(2,3)4/h9H,6-8H2,1-5H3
InChIKey CRZKVDMJKGJZHQ-UHFFFAOYSA-N
Mol Weight 182.31 g/mol
Molecular Formula C12H22O
Exact Mass 182.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2NVSbLtcC8
Name 3-Hexanone, 2,2-dimethyl-5-(1-methylcyclopropyl)-
CAS Registry Number 56068-48-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O
InChI InChI=1S/C12H22O/c1-9(12(5)6-7-12)8-10(13)11(2,3)4/h9H,6-8H2,1-5H3
InChIKey CRZKVDMJKGJZHQ-UHFFFAOYSA-N
Molecular Weight 182.307 g/mol
SMILES C1(CC1)(C(CC(C(C)(C)C)=O)C)C
SPLASH splash10-0a4i-9200000000-1e5d98b983d4d3860814
Source of Spectrum C-97-2783-0
Synonyms 2,2-Dimethyl-5-(1-methylcyclopropyl)-3-hexanone 5-(1'-Methylcyclopropyl)-2,2-dimethyl-3-hexanone
Wiley ID 1179094