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t-Butyl (4S,5S,2Z)-3-Amino-4,5-(cyclohexylidenedioxy)-2-hexenoate
SpectraBase Compound ID JtpBF3MwNid
InChI InChI=1S/C16H27NO4/c1-11-14(12(17)10-13(18)20-15(2,3)4)21-16(19-11)8-6-5-7-9-16/h10-11,14H,5-9,17H2,1-4H3/b12-10-/t11-,14+/m0/s1
InChIKey VHGGLRFWMUXJRF-SFQAMRQYSA-N
Mol Weight 297.39 g/mol
Molecular Formula C16H27NO4
Exact Mass 297.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BEXfmY2ojdU
Name t-Butyl (4S,5S,2Z)-3-Amino-4,5-(cyclohexylidenedioxy)-2-hexenoate
CAS Registry Number 99630-06-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO4
InChI InChI=1S/C16H27NO4/c1-11-14(12(17)10-13(18)20-15(2,3)4)21-16(19-11)8-6-5-7-9-16/h10-11,14H,5-9,17H2,1-4H3/b12-10-/t11-,14+/m0/s1
InChIKey VHGGLRFWMUXJRF-SFQAMRQYSA-N
Molecular Weight 297.395 g/mol
SMILES N\C([C@@]1(OC2(CCCCC2)O[C@]1(C)[H])[H])=C/C(OC(C)(C)C)=O
SPLASH splash10-002g-3900000000-76a0fbe798f302950a1c
Source of Spectrum AJ-60-2134-16
Synonyms tert-Butyl (2Z)-3-amino-3-[(2S,3S)-3-methyl-1,4-dioxaspiro[4.5]dec-2-yl]-2-propenoate
Wiley ID 1300104