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(R)-N-Benzylallylglycine-phenylmenthyl ester
SpectraBase Compound ID Fi0R5BowgLT
InChI InChI=1S/C28H37NO2/c1-5-12-25(29-20-22-13-8-6-9-14-22)27(30)31-26-19-21(2)17-18-24(26)28(3,4)23-15-10-7-11-16-23/h5-11,13-16,21,24-26,29H,1,12,17-20H2,2-4H3/t21?,24?,25-,26?/m1/s1
InChIKey BHTJROWMCVLMNW-ICHFMVBPSA-N
Mol Weight 419.6 g/mol
Molecular Formula C28H37NO2
Exact Mass 419.282429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXgMaTv6q47
Name (R)-N-Benzylallylglycine-phenylmenthyl ester
Alternate Name(s) (RS)-N-Benzylallylglycine 8(R)-phenylmenthyl ester 5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl (2R)-2-(benzylamino)-4-pentenoate
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Formula C28H37NO2
InChI InChI=1S/C28H37NO2/c1-5-12-25(29-20-22-13-8-6-9-14-22)27(30)31-26-19-21(2)17-18-24(26)28(3,4)23-15-10-7-11-16-23/h5-11,13-16,21,24-26,29H,1,12,17-20H2,2-4H3/t21?,24?,25-,26?/m1/s1
InChIKey BHTJROWMCVLMNW-ICHFMVBPSA-N
Molecular Weight 419.609 g/mol
SMILES N([C@@](C(OC1C(C(c2ccccc2)(C)C)CCC(C1)C)=O)(CC=C)[H])Cc1ccccc1
SPLASH splash10-03dl-3903200000-ddb7d5c03659ab97b995
Source of Spectrum KD-13-2067-9
Wiley ID 1635515