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Cyclopentanecarboxaldehyde, 2-methyl-5-(1-methylethyl)-1-(3-oxobutyl)-, (1.alpha.,2.alpha.,5.alpha.)-
SpectraBase Compound ID SSxRemf3Ky
InChI InChI=1S/C14H24O2/c1-10(2)13-6-5-11(3)14(13,9-15)8-7-12(4)16/h9-11,13H,5-8H2,1-4H3/t11-,13-,14+/m0/s1
InChIKey CCUPBDYAWFWFRX-FPMFFAJLSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYb0BPNwyvq
Name Cyclopentanecarboxaldehyde, 2-methyl-5-(1-methylethyl)-1-(3-oxobutyl)-, (1.alpha.,2.alpha.,5.alpha.)-
CAS Registry Number 57683-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-10(2)13-6-5-11(3)14(13,9-15)8-7-12(4)16/h9-11,13H,5-8H2,1-4H3/t11-,13-,14+/m0/s1
InChIKey CCUPBDYAWFWFRX-FPMFFAJLSA-N
Molecular Weight 224.344 g/mol
SMILES [C@@]1([C@@](CC[C@@]1(C)[H])(C(C)C)[H])(CCC(=O)C)C=O
SPLASH splash10-0006-9100000000-9adffc31b5191988c705
Source of Spectrum C-97-5876-0
Synonyms (1R,2S,5S)-2-isopropyl-5-methyl-1-(3-oxobutyl)cyclopentanecarbaldehyde (Z)-2-Isopropyl-(Z)-5-methyl-1-(3-oxobutyl)-1-cyclopentanecarboxaldehyde
Wiley ID 1225575