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Benzyl 2(S)-(tert-Butoxycarbonyl)amino]-4(R/S)-phenylhex-5-enoate
SpectraBase Compound ID EdZazIrzWW2
InChI InChI=1S/C24H29NO4/c1-5-19(20-14-10-7-11-15-20)16-21(25-23(27)29-24(2,3)4)22(26)28-17-18-12-8-6-9-13-18/h5-15,19,21H,1,16-17H2,2-4H3,(H,25,27)/t19?,21-/m0/s1
InChIKey IIMNFIWFXVHBJM-QWAKEFERSA-N
Mol Weight 395.5 g/mol
Molecular Formula C24H29NO4
Exact Mass 395.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2tSJZ5HorB
Name Benzyl 2(S)-(tert-Butoxycarbonyl)amino]-4(R/S)-phenylhex-5-enoate
Alternate Name(s) benzyl (2S)-2-[(tert-butoxycarbonyl)amino]-4-phenyl-5-hexenoate
Comments Less than 3 mono-isotopic peaks
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Formula C24H29NO4
InChI InChI=1S/C24H29NO4/c1-5-19(20-14-10-7-11-15-20)16-21(25-23(27)29-24(2,3)4)22(26)28-17-18-12-8-6-9-13-18/h5-15,19,21H,1,16-17H2,2-4H3,(H,25,27)/t19?,21-/m0/s1
InChIKey IIMNFIWFXVHBJM-QWAKEFERSA-N
Molecular Weight 395.499 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(OCc1ccccc1)=O)(CC(C=C)c1ccccc1)[H]
SPLASH splash10-0002-0090000000-766614db0dfe93d5d987
Source of Spectrum J-60-2213-9
Wiley ID 1367130