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2-(E)-Pentenoic acid, (4S)-4-[(t-butoxycarbonyl)amino]-5-phenyl-, methyl ester
SpectraBase Compound ID 2tHgZL3ffbz
InChI InChI=1S/C17H23NO4/c1-17(2,3)22-16(20)18-14(10-11-15(19)21-4)12-13-8-6-5-7-9-13/h5-11,14H,12H2,1-4H3,(H,18,20)/b11-10+
InChIKey IFHLOKCQHZUORN-ZHACJKMWSA-N
Mol Weight 305.37 g/mol
Molecular Formula C17H23NO4
Exact Mass 305.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cb2ORmMVGLb
Name 2-(E)-Pentenoic acid, (4S)-4-[(t-butoxycarbonyl)amino]-5-phenyl-, methyl ester
Alternate Name(s) (E)-4-(tert-butoxycarbonylamino)-5-phenyl-pent-2-enoic acid methyl ester (E)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenyl-2-pentenoic acid methyl ester Methyl (2E)-4-[(tert-butoxycarbonyl)amino]-5-phenyl-2-pentenoate Methyl (E)-4-(tert-butoxycarbonylamino)-5-phenyl-pent-2-enoate Methyl (E)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-2-enoate
CAS Registry Number 115650-05-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO4
InChI InChI=1S/C17H23NO4/c1-17(2,3)22-16(20)18-14(10-11-15(19)21-4)12-13-8-6-5-7-9-13/h5-11,14H,12H2,1-4H3,(H,18,20)/b11-10+
InChIKey IFHLOKCQHZUORN-ZHACJKMWSA-N
Molecular Weight 305.374 g/mol
SMILES N(C(OC(C)(C)C)=O)C(Cc1ccccc1)\C=C\C(=O)OC
SPLASH splash10-0bt9-9500000000-c0e6f79b5e94adb16e3f
Wiley ID 1490389