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5-((1S)-2,2,3-trimethylcyclopentyl)pentanal
SpectraBase Compound ID BAKlfDbefL7
InChI InChI=1S/C13H24O/c1-11-8-9-12(13(11,2)3)7-5-4-6-10-14/h10-12H,4-9H2,1-3H3/t11?,12-/m0/s1
InChIKey JSLDBLQKICDBBV-KIYNQFGBSA-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 AvX9PXN9wNc
Name 5-((1S)-2,2,3-trimethylcyclopentyl)pentanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O
InChI InChI=1S/C13H24O/c1-11-8-9-12(13(11,2)3)7-5-4-6-10-14/h10-12H,4-9H2,1-3H3/t11?,12-/m0/s1
InChIKey JSLDBLQKICDBBV-KIYNQFGBSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Molecular Weight 196.334 g/mol
SMILES C1CC(C([C@]1(CCCCC=O)[H])(C)C)C
SPLASH splash10-07x0-9400000000-562a6b660025fde013f3
Sample Comments 81% ee
Source of Spectrum JP5839191B2
Wiley ID 1853066