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Cyclopentanone, 2-(1-methylheptyl)-
SpectraBase Compound ID 9omDA0mU8oK
InChI InChI=1S/C13H24O/c1-3-4-5-6-8-11(2)12-9-7-10-13(12)14/h11-12H,3-10H2,1-2H3
InChIKey VFGXVQOCGXKXDW-UHFFFAOYSA-N
Mol Weight 196.33 g/mol
Molecular Formula C13H24O
Exact Mass 196.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 853oCsU9CDZ
Name Cyclopentanone, 2-(1-methylheptyl)-
CAS Registry Number 54549-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O
InChI InChI=1S/C13H24O/c1-3-4-5-6-8-11(2)12-9-7-10-13(12)14/h11-12H,3-10H2,1-2H3
InChIKey VFGXVQOCGXKXDW-UHFFFAOYSA-N
Molecular Weight 196.334 g/mol
SMILES C(C(C)C1C(=O)CCC1)CCCCC
SPLASH splash10-001i-9100000000-88d920d1e4dccbb4c672
Source of Spectrum SD-1981-0-0
Synonyms 2-(1-Methylheptyl)cyclopentanone 2-Octan-2-yl-1-cyclopentanone 2-Octan-2-ylcyclopentan-1-one
Wiley ID 1193890