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2-(Allylbenzylcarbamoyl)pent-4-enoic acid methyl ester
SpectraBase Compound ID HFs5vZJQftT
InChI InChI=1S/C17H21NO3/c1-4-9-15(17(20)21-3)16(19)18(12-5-2)13-14-10-7-6-8-11-14/h4-8,10-11,15H,1-2,9,12-13H2,3H3
InChIKey JTPCOUQJLDEQPN-UHFFFAOYSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVJ6bhTTyl4
Name 2-(Allylbenzylcarbamoyl)pent-4-enoic acid methyl ester
Alternate Name(s) Methyl 2-{[allyl(benzyl)amino]carbonyl}-4-pentenoate
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Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-4-9-15(17(20)21-3)16(19)18(12-5-2)13-14-10-7-6-8-11-14/h4-8,10-11,15H,1-2,9,12-13H2,3H3
InChIKey JTPCOUQJLDEQPN-UHFFFAOYSA-N
Molecular Weight 287.359 g/mol
SMILES C(C(CC=C)C(N(Cc1ccccc1)CC=C)=O)(=O)OC
SPLASH splash10-000b-0390000000-0d4770971268f08529e8
Source of Spectrum F-62-1782-16
Wiley ID 1632365