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(S)-1-(1-tert-Butyloxycarbonyl)-6-chloro-5-methoxytryptophan Ethyl Ester
SpectraBase Compound ID LtDLIB4jP7d
InChI InChI=1S/C19H25ClN2O5/c1-6-26-17(23)14(21)7-11-10-22(18(24)27-19(2,3)4)15-9-13(20)16(25-5)8-12(11)15/h8-10,14H,6-7,21H2,1-5H3/t14-/m0/s1
InChIKey ILVFCEFUBHVJOD-AWEZNQCLSA-N
Mol Weight 396.87 g/mol
Molecular Formula C19H25ClN2O5
Exact Mass 396.1452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID p2R4DJLkoL
Name (S)-1-(1-tert-Butyloxycarbonyl)-6-chloro-5-methoxytryptophan Ethyl Ester
Alternate Name(s) tert-Butyl 3-[(2S)-2-amino-3-ethoxy-3-oxopropyl]-6-chloro-5-methoxy-1H-indole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25ClN2O5
InChI InChI=1S/C19H25ClN2O5/c1-6-26-17(23)14(21)7-11-10-22(18(24)27-19(2,3)4)15-9-13(20)16(25-5)8-12(11)15/h8-10,14H,6-7,21H2,1-5H3/t14-/m0/s1
InChIKey ILVFCEFUBHVJOD-AWEZNQCLSA-N
Molecular Weight 396.871 g/mol
SMILES N[C@](C(=O)OCC)(Cc1c[n](c2c1cc(c(c2)Cl)OC)C(OC(C)(C)C)=O)[H]
SPLASH splash10-0006-0900000000-167ab5dd00fb249819c5
Source of Spectrum J-62-7454-19
Wiley ID 1367341