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4-Dibenzylcarbamoyl-4-hydroxy-pent-2-ynoic acid methyl ester
SpectraBase Compound ID LGUVNv9xvrH
InChI InChI=1S/C21H21NO4/c1-21(25,14-13-19(23)26-2)20(24)22(15-17-9-5-3-6-10-17)16-18-11-7-4-8-12-18/h3-12,25H,15-16H2,1-2H3
InChIKey NCNWRQBSBSQHSK-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C21H21NO4
Exact Mass 351.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58RxW4loHaI
Name 4-Dibenzylcarbamoyl-4-hydroxy-pent-2-ynoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO4
InChI InChI=1S/C21H21NO4/c1-21(25,14-13-19(23)26-2)20(24)22(15-17-9-5-3-6-10-17)16-18-11-7-4-8-12-18/h3-12,25H,15-16H2,1-2H3
InChIKey NCNWRQBSBSQHSK-UHFFFAOYSA-N
Molecular Weight 351.402 g/mol
SMILES OC(C#CC(=O)OC)(C(N(Cc1ccccc1)Cc1ccccc1)=O)C
SPLASH splash10-006x-9131000000-594a15d4f41f92dcb728
Source of Spectrum U1-2010-36-15
Synonyms Methyl 2-Hydroxy-2-(N.N-dibenzylcarbonyl)pent-2-ynoate 5-[bis(phenylmethyl)amino]-4-hydroxy-4-methyl-5-oxo-2-pentynoic acid methyl ester Methyl 5-(dibenzylamino)-4-hydroxy-4-methyl-5-oxopent-2-ynoate Methyl 5-(dibenzylamino)-4-hydroxy-4-methyl-5-oxo-pent-2-ynoate Methyl 5-[bis(phenylmethyl)amino]-4-methyl-4-oxidanyl-5-oxidanylidene-pent-2-ynoate
Wiley ID 1663326