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4-Hexyl-2-pentylcyclopent-2-en-1-one

View entire compound with spectra: 1 MS (GC)

4-Hexyl-2-pentylcyclopent-2-en-1-one
SpectraBase Compound ID BTKkqmVWuU3
InChI InChI=1S/C16H28O/c1-3-5-7-9-10-14-12-15(16(17)13-14)11-8-6-4-2/h12,14H,3-11,13H2,1-2H3
InChIKey YBNDBKQYABSMOR-UHFFFAOYSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ltl4JK5VP3G
Name 4-Hexyl-2-pentylcyclopent-2-en-1-one
Alternate Name(s) 4-Hexyl-2-pentyl-2-cyclopenten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O
InChI InChI=1S/C16H28O/c1-3-5-7-9-10-14-12-15(16(17)13-14)11-8-6-4-2/h12,14H,3-11,13H2,1-2H3
InChIKey YBNDBKQYABSMOR-UHFFFAOYSA-N
Molecular Weight 236.399 g/mol
SMILES C=1(C(CC(C1)CCCCCC)=O)CCCCC
SPLASH splash10-0pba-9300000000-d19580decd420877a4e1
Source of Spectrum F-50-6963-8
Wiley ID 1239088