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Ethyl 2-(2-benzothiazolylamino)-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoropropionate
SpectraBase Compound ID BGVRm28tcVO
InChI InChI=1S/C15H16F3N3O4S/c1-3-24-11(22)14(15(16,17)18,21-13(23)25-4-2)20-12-19-9-7-5-6-8-10(9)26-12/h5-8H,3-4H2,1-2H3,(H,19,20)(H,21,23)
InChIKey BQUIXVDHQALXQA-UHFFFAOYSA-N
Mol Weight 391.37 g/mol
Molecular Formula C15H16F3N3O4S
Exact Mass 391.081362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K43MUGgshHn
Name Ethyl 2-(2-benzothiazolylamino)-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoropropionate
CAS Registry Number 330181-54-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16F3N3O4S
InChI InChI=1S/C15H16F3N3O4S/c1-3-24-11(22)14(15(16,17)18,21-13(23)25-4-2)20-12-19-9-7-5-6-8-10(9)26-12/h5-8H,3-4H2,1-2H3,(H,19,20)(H,21,23)
InChIKey BQUIXVDHQALXQA-UHFFFAOYSA-N
Molecular Weight 391.365 g/mol
SMILES N(c1nc2ccccc2s1)C(C(=O)OCC)(C(F)(F)F)NC(=O)OCC
SPLASH splash10-0uxr-4933000000-949037518344ce946e48
Synonyms 2-(1,3-benzothiazol-2-ylamino)-2-(carbethoxyamino)-3,3,3-trifluoro-propionic acid ethyl ester 2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoic acid ethyl ester Ethyl 2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-trifluoro-propanoate Ethyl 2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-tris(fluoranyl)propanoate
Wiley ID 1467930