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2-Butenoic acid, 3-amino-4,4,4-trichloro-, 1,1-dimethylethyl ester, (Z)-
SpectraBase Compound ID Jq6guturMXE
InChI InChI=1S/C8H12Cl3NO2/c1-7(2,3)14-6(13)4-5(12)8(9,10)11/h4H,12H2,1-3H3/b5-4-
InChIKey UWDGCUUMWFZIBH-PLNGDYQASA-N
Mol Weight 260.55 g/mol
Molecular Formula C8H12Cl3NO2
Exact Mass 258.993362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dNWVPDGyCQ
Name 2-Butenoic acid, 3-amino-4,4,4-trichloro-, 1,1-dimethylethyl ester, (Z)-
Alternate Name(s) t-Butyl 3-amino-4,4,4-trichloro-2-butenoate tert-Butyl (2Z)-3-amino-4,4,4-trichloro-2-butenoate
CAS Registry Number 115131-63-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12Cl3NO2
InChI InChI=1S/C8H12Cl3NO2/c1-7(2,3)14-6(13)4-5(12)8(9,10)11/h4H,12H2,1-3H3/b5-4-
InChIKey UWDGCUUMWFZIBH-PLNGDYQASA-N
Molecular Weight 260.548 g/mol
SMILES N\C(C(Cl)(Cl)Cl)=C/C(OC(C)(C)C)=O
SPLASH splash10-0a4i-9360000000-542851bf9a4d7ff49be5
Source of Spectrum AJ-60-2133-2
Wiley ID 1262455