For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5,5,5-trichloro-4-keto-valeric acid
SpectraBase Compound ID 1igVYOIpAMa
InChI InChI=1S/C5H5Cl3O3/c6-5(7,8)3(9)1-2-4(10)11/h1-2H2,(H,10,11)
InChIKey CQKIKRVNPZYPRV-UHFFFAOYSA-N
Mol Weight 219.45 g/mol
Molecular Formula C5H5Cl3O3
Exact Mass 217.930427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CtB4qqyFfY5
Name 5,5,5-trichloro-4-keto-valeric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H5Cl3O3
InChI InChI=1S/C5H5Cl3O3/c6-5(7,8)3(9)1-2-4(10)11/h1-2H2,(H,10,11)
InChIKey CQKIKRVNPZYPRV-UHFFFAOYSA-N
Molecular Weight 219.451 g/mol
SMILES OC(CCC(C(Cl)(Cl)Cl)=O)=O
SPLASH splash10-0udi-5900000000-b50f1ca5085b678a4bd3
Source of Spectrum F-49-10957-0
Synonyms 5,5,5-trichloro-4-oxo-pentanoic acid 5,5,5-tris(chloranyl)-4-oxidanylidene-pentanoic acid
Wiley ID 788846