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2-Benzothiazolylthioacetyl L-tyrosine hydrazide
SpectraBase Compound ID AImzQeiHYcH
InChI InChI=1S/C18H18N4O3S2/c19-22-17(25)14(9-11-5-7-12(23)8-6-11)20-16(24)10-26-18-21-13-3-1-2-4-15(13)27-18/h1-8,14,23H,9-10,19H2,(H,20,24)(H,22,25)/t14-/m0/s1
InChIKey QFMHWQVHWKBRGI-AWEZNQCLSA-N
Mol Weight 402.49 g/mol
Molecular Formula C18H18N4O3S2
Exact Mass 402.082033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFrVHpT3WGL
Name 2-Benzothiazolylthioacetyl L-tyrosine hydrazide
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N4O3S2
InChI InChI=1S/C18H18N4O3S2/c19-22-17(25)14(9-11-5-7-12(23)8-6-11)20-16(24)10-26-18-21-13-3-1-2-4-15(13)27-18/h1-8,14,23H,9-10,19H2,(H,20,24)(H,22,25)/t14-/m0/s1
InChIKey QFMHWQVHWKBRGI-AWEZNQCLSA-N
Instrument Name Shimadzu GC-MSQP 1000EX
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0012.925
Molecular Weight 402.487 g/mol
SMILES N(C(CSc1nc2c(cccc2)s1)=O)[C@@](Cc1ccc(cc1)O)(C(NN)=O)[H]
SPLASH splash10-0a4i-0960000000-061c2eefb20fe0fed1c3
Source of Spectrum ARK-2011-345-4a
Thin-Layer Chromatography Rf = 0.52 (Chloroform/Methanol, 90:10)
Wiley ID 1864521