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(R)-Ethyl 2-[(tert-butoxycarbonyl)amino]-3,3,3-trifluoro-2-(5-methyl-1H-indol-3-yl)propanoate

View entire compound with spectra: 1 MS (GC)

(R)-Ethyl 2-[(tert-butoxycarbonyl)amino]-3,3,3-trifluoro-2-(5-methyl-1H-indol-3-yl)propanoate
SpectraBase Compound ID 1680fpU6EoM
InChI InChI=1S/C19H23F3N2O4/c1-6-27-15(25)18(19(20,21)22,24-16(26)28-17(3,4)5)13-10-23-14-8-7-11(2)9-12(13)14/h7-10,23H,6H2,1-5H3,(H,24,26)/t18-/m1/s1
InChIKey BVXMUFNWWDVAEC-GOSISDBHSA-N
Mol Weight 400.4 g/mol
Molecular Formula C19H23F3N2O4
Exact Mass 400.160992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HC4vUFdWpKT
Name (R)-Ethyl 2-[(tert-butoxycarbonyl)amino]-3,3,3-trifluoro-2-(5-methyl-1H-indol-3-yl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23F3N2O4
InChI InChI=1S/C19H23F3N2O4/c1-6-27-15(25)18(19(20,21)22,24-16(26)28-17(3,4)5)13-10-23-14-8-7-11(2)9-12(13)14/h7-10,23H,6H2,1-5H3,(H,24,26)/t18-/m1/s1
InChIKey BVXMUFNWWDVAEC-GOSISDBHSA-N
Literature Reference DOI 10.1021/ol103093r
Molecular Weight 400.398 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](c1c2c(ccc(c2)C)[nH]c1)(C(=O)OCC)C(F)(F)F
SPLASH splash10-0pb9-9180500000-800dc78033f330ff13ba
Source of Spectrum A1-13-1044/SMS6-4h
Synonyms (R)-ethyl 2-((tert-butoxycarbonyl)amino)-3,3,3-trifluoro-2-(5-methyl-1H-indol-3-yl)propanoate
Wiley ID 1752828