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(2S)-2-[(2-chloro-1-oxoethyl)amino]-3-(1H-indol-3-yl)propanoic acid methyl ester
SpectraBase Compound ID 681EqwZXrQp
InChI InChI=1S/C14H15ClN2O3/c1-20-14(19)12(17-13(18)7-15)6-9-8-16-11-5-3-2-4-10(9)11/h2-5,8,12,16H,6-7H2,1H3,(H,17,18)/t12-/m0/s1
InChIKey KDURQOJTVSURJA-LBPRGKRZSA-N
Mol Weight 294.74 g/mol
Molecular Formula C14H15ClN2O3
Exact Mass 294.07712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSj3SgTFH0X
Name (2S)-2-[(2-chloro-1-oxoethyl)amino]-3-(1H-indol-3-yl)propanoic acid methyl ester
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Formula C14H15ClN2O3
InChI InChI=1S/C14H15ClN2O3/c1-20-14(19)12(17-13(18)7-15)6-9-8-16-11-5-3-2-4-10(9)11/h2-5,8,12,16H,6-7H2,1H3,(H,17,18)/t12-/m0/s1
InChIKey KDURQOJTVSURJA-LBPRGKRZSA-N
Molecular Weight 294.738 g/mol
SMILES [nH]1c2c(c(C[C@@](C(=O)OC)(NC(=O)CCl)[H])c1)cccc2
SPLASH splash10-001i-0920000000-3647c0ef37b25120aee2
Source of Spectrum KC-1992-804-16
Synonyms (2S)-2-[(2-chloroacetyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Methyl (2S)-2-(2-chloranylethanoylamino)-3-(1H-indol-3-yl)propanoate Methyl (2S)-2-[(2-chloroacetyl)amino]-3-(1H-indol-3-yl)propanoate
Wiley ID 776289