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3-[4-[N-(tert-Butyloxycarbonyl)amino]-5-hexenoic acid
SpectraBase Compound ID GkBcKxxYHJA
InChI InChI=1S/C17H21NO4/c1-5-6-13(11-15(19)20)12-7-9-14(10-8-12)18-16(21)22-17(2,3)4/h1,7-10,13H,6,11H2,2-4H3,(H,18,21)(H,19,20)
InChIKey XUIXIGFCHXYGOS-UHFFFAOYSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FRieeeOoJy
Name 3-[4-[N-(tert-Butyloxycarbonyl)amino]-5-hexenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-5-6-13(11-15(19)20)12-7-9-14(10-8-12)18-16(21)22-17(2,3)4/h1,7-10,13H,6,11H2,2-4H3,(H,18,21)(H,19,20)
InChIKey XUIXIGFCHXYGOS-UHFFFAOYSA-N
Molecular Weight 303.358 g/mol
SMILES N(C(OC(C)(C)C)=O)c1ccc(C(CC(=O)O)CC#C)cc1
SPLASH splash10-0a4i-9400000000-b14ca2558283db775543
Source of Spectrum E1-35-4256-16
Synonyms 3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-5-hexynoic acid 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]hex-5-ynoic acid
Wiley ID 1574491