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cis-2-isopropyl-3,3,5-trimethylcyclopentanone
SpectraBase Compound ID 54c9TpTe9kd
InChI InChI=1S/C11H20O/c1-7(2)9-10(12)8(3)6-11(9,4)5/h7-9H,6H2,1-5H3/t8-,9-/m0/s1
InChIKey CTTNCIVJOUSLSY-IUCAKERBSA-N
Mol Weight 168.28 g/mol
Molecular Formula C11H20O
Exact Mass 168.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADNl83rUic2
Name cis-2-isopropyl-3,3,5-trimethylcyclopentanone
CAS Registry Number 116786-29-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O
InChI InChI=1S/C11H20O/c1-7(2)9-10(12)8(3)6-11(9,4)5/h7-9H,6H2,1-5H3/t8-,9-/m0/s1
InChIKey CTTNCIVJOUSLSY-IUCAKERBSA-N
Molecular Weight 168.280 g/mol
SMILES C1([C@](C(=O)[C@](C1)(C)[H])(C(C)C)[H])(C)C
SPLASH splash10-040r-7900000000-3a123c9ddefe11ad28bb
Source of Spectrum K-122-157-0
Synonyms (2R,5S)-2-isopropyl-3,3,5-trimethylcyclopentanone
Wiley ID 1165250