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3-Methoxycarbonylmethyl-indole-1-carboxylic acid, 2,2,2-trichloroethyl ester
SpectraBase Compound ID 7BvxRkzrVEr
InChI InChI=1S/C14H12Cl3NO4/c1-21-12(19)6-9-7-18(11-5-3-2-4-10(9)11)13(20)22-8-14(15,16)17/h2-5,7H,6,8H2,1H3
InChIKey URVUKRGKIMDOQH-UHFFFAOYSA-N
Mol Weight 364.61 g/mol
Molecular Formula C14H12Cl3NO4
Exact Mass 362.983191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69Bou1IKT47
Name 3-Methoxycarbonylmethyl-indole-1-carboxylic acid, 2,2,2-trichloroethyl ester
Alternate Name(s) 2,2,2-trichloroethyl 3-(2-methoxy-2-oxo-ethyl)indole-1-carboxylate 2,2,2-Trichloroethyl 3-(2-methoxy-2-oxoethyl)-1H-indole-1-carboxylate 2,2,2-tris(chloranyl)ethyl 3-(2-methoxy-2-oxidanylidene-ethyl)indole-1-carboxylate 3-(2-keto-2-methoxy-ethyl)indole-1-carboxylic acid 2,2,2-trichloroethyl ester 3-(2-Methoxy-2-oxoethyl)-1-indolecarboxylic acid 2,2,2-trichloroethyl ester
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Formula C14H12Cl3NO4
InChI InChI=1S/C14H12Cl3NO4/c1-21-12(19)6-9-7-18(11-5-3-2-4-10(9)11)13(20)22-8-14(15,16)17/h2-5,7H,6,8H2,1H3
InChIKey URVUKRGKIMDOQH-UHFFFAOYSA-N
Molecular Weight 364.612 g/mol
SMILES C(Cl)(COC([n]1cc(c2c1cccc2)CC(=O)OC)=O)(Cl)Cl
SPLASH splash10-0f89-6904000000-a07da26484eb60660b95
Wiley ID 1481914