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(S)-.alpha.-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(2-propenyl)benzenepropanoic acid phenylmethyl ester
SpectraBase Compound ID Beu9geHtsBJ
InChI InChI=1S/C24H29NO4/c1-5-9-18-12-14-19(15-13-18)16-21(25-23(27)29-24(2,3)4)22(26)28-17-20-10-7-6-8-11-20/h5-8,10-15,21H,1,9,16-17H2,2-4H3,(H,25,27)/t21-/m0/s1
InChIKey HWWVZKOTQPKPLF-NRFANRHFSA-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 9QXDzt5luDa
Name (S)-.alpha.-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(2-propenyl)benzenepropanoic acid phenylmethyl ester
Alternate Name(s) benzyl (2S)-3-(4-allylphenyl)-2-[(tert-butoxycarbonyl)amino]propanoate
CAS Registry Number 123993-25-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H29NO4
InChI InChI=1S/C24H29NO4/c1-5-9-18-12-14-19(15-13-18)16-21(25-23(27)29-24(2,3)4)22(26)28-17-20-10-7-6-8-11-20/h5-8,10-15,21H,1,9,16-17H2,2-4H3,(H,25,27)/t21-/m0/s1
InChIKey HWWVZKOTQPKPLF-NRFANRHFSA-N
Molecular Weight 395.499 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(OCc1ccccc1)=O)(Cc1ccc(cc1)CC=C)[H]
SPLASH splash10-0a4i-9210000000-8e5d1d3fa1d1fe357cee
Source of Spectrum J-55-909-5
Wiley ID 1367129