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3-(Trichloromethyl)-3-hydroxy-2-pentylpropan-1-al
SpectraBase Compound ID 9a5ZdroSOsu
InChI InChI=1S/C9H15Cl3O2/c1-2-3-4-5-7(6-13)8(14)9(10,11)12/h6-8,14H,2-5H2,1H3
InChIKey CMHQDGSPZPTCBJ-UHFFFAOYSA-N
Mol Weight 261.58 g/mol
Molecular Formula C9H15Cl3O2
Exact Mass 260.013763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BN2B65BicY
Name 3-(Trichloromethyl)-3-hydroxy-2-pentylpropan-1-al
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15Cl3O2
InChI InChI=1S/C9H15Cl3O2/c1-2-3-4-5-7(6-13)8(14)9(10,11)12/h6-8,14H,2-5H2,1H3
InChIKey CMHQDGSPZPTCBJ-UHFFFAOYSA-N
Molecular Weight 261.576 g/mol
SMILES OC(C(C=O)CCCCC)C(Cl)(Cl)Cl
SPLASH splash10-00di-8910000000-9d7994faf1a72cadae35
Source of Spectrum D1-2006-1706-5
Synonyms 2-(2,2,2-trichloro-1-hydroxyethyl)heptanal
Wiley ID 1614122