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2-methyl-1,1,1-trichloro-2-propanol, hemihydrate
SpectraBase Compound ID 2c48CladZnD
InChI InChI=1S/2C4H7Cl3O.H2O/c2*1-3(2,8)4(5,6)7;/h2*8H,1-2H3;1H2
InChIKey WRWLCXJYIMRJIN-UHFFFAOYSA-N
Mol Weight 372.93 g/mol
Molecular Formula C8H16Cl6O3
Exact Mass 369.923061 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CZEVqMb3V83
Name 2-METHYL-1,1,1-TRICHLORO-2-PROPANOL, HEMIHYDRATE
Source of Sample E. Merck AG, Darmstadt, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H7Cl3O 1/2H2O
InChI InChI=1S/2C4H7Cl3O.H2O/c2*1-3(2,8)4(5,6)7;/h2*8H,1-2H3;1H2
InChIKey WRWLCXJYIMRJIN-UHFFFAOYSA-N
Melting Point 78C
Molecular Weight 186.47
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2-PROPANOL, 2-METHYL-1,1,1-TRICHLORO-, HEMIHYDRATE