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2-(Pentachloroethyl)heptanal
SpectraBase Compound ID J60KKP8bUKQ
InChI InChI=1S/C9H13Cl5O/c1-2-3-4-5-7(6-15)8(10,11)9(12,13)14/h6-7H,2-5H2,1H3
InChIKey IOMKFLYLPCYCGT-UHFFFAOYSA-N
Mol Weight 314.5 g/mol
Molecular Formula C9H13Cl5O
Exact Mass 311.940904 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PrCIFSdLuD
Name 2-(Pentachloroethyl)heptanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13Cl5O
InChI InChI=1S/C9H13Cl5O/c1-2-3-4-5-7(6-15)8(10,11)9(12,13)14/h6-7H,2-5H2,1H3
InChIKey IOMKFLYLPCYCGT-UHFFFAOYSA-N
Molecular Weight 314.467 g/mol
SMILES C(C(CCCCC)C(C(Cl)(Cl)Cl)(Cl)Cl)=O
SPLASH splash10-004i-0900000000-bc2825c8659600568236
Source of Spectrum AJ-75-1812-7
Synonyms 2-(1,1,2,2,2-Pentachloroethyl)heptanal
Wiley ID 1577098