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(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-hex-5-enoic acid tert-butyl ester
SpectraBase Compound ID KlTvgLYUNLO
InChI InChI=1S/C25H27NO5/c1-5-16(27)14-22(23(28)31-25(2,3)4)26-24(29)30-15-21-19-12-8-6-10-17(19)18-11-7-9-13-20(18)21/h5-13,21-22H,1,14-15H2,2-4H3,(H,26,29)/t22-/m0/s1
InChIKey CTQWXCBAFTXXPH-QFIPXVFZSA-N
Mol Weight 421.49 g/mol
Molecular Formula C25H27NO5
Exact Mass 421.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2yLcqS6Vj14
Name (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-hex-5-enoic acid tert-butyl ester
Alternate Name(s) (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-oxo-5-hexenoic acid tert-butyl ester tert-Butyl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-hex-5-enoate tert-Butyl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-hex-5-enoate
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Formula C25H27NO5
InChI InChI=1S/C25H27NO5/c1-5-16(27)14-22(23(28)31-25(2,3)4)26-24(29)30-15-21-19-12-8-6-10-17(19)18-11-7-9-13-20(18)21/h5-13,21-22H,1,14-15H2,2-4H3,(H,26,29)/t22-/m0/s1
InChIKey CTQWXCBAFTXXPH-QFIPXVFZSA-N
Molecular Weight 421.493 g/mol
SMILES N([C@](C(OC(C)(C)C)=O)(CC(C=C)=O)[H])C(OCC1c2c(cccc2)-c2c1cccc2)=O
SPLASH splash10-004i-0900000000-83604f77aa18426c76c6
Source of Spectrum K-2001-1884-12
Wiley ID 1579408