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[(E)(S)-1-Benzyl-4-methylene-6-phenylhex-2-enyl]carbamic acid t-butyl ester
SpectraBase Compound ID 7vT3Jkblg0z
InChI InChI=1S/C25H31NO2/c1-20(15-17-21-11-7-5-8-12-21)16-18-23(19-22-13-9-6-10-14-22)26-24(27)28-25(2,3)4/h5-14,16,18,23H,1,15,17,19H2,2-4H3,(H,26,27)/b18-16+/t23-/m1/s1
InChIKey FDWPVGQNIRKDCR-YJCCFKNTSA-N
Mol Weight 377.53 g/mol
Molecular Formula C25H31NO2
Exact Mass 377.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvBtNMxl8yF
Name [(E)(S)-1-Benzyl-4-methylene-6-phenylhex-2-enyl]carbamic acid t-butyl ester
Alternate Name(s) tert-butyl (1S,2E)-1-benzyl-4-(2-phenylethyl)-2,4-pentadienylcarbamate [(E)(R)-1-Benzyl-4-methylene-6-phenylhex-2-enyl]carbamic acid t-butyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C25H31NO2
InChI InChI=1S/C25H31NO2/c1-20(15-17-21-11-7-5-8-12-21)16-18-23(19-22-13-9-6-10-14-22)26-24(27)28-25(2,3)4/h5-14,16,18,23H,1,15,17,19H2,2-4H3,(H,26,27)/b18-16+/t23-/m1/s1
InChIKey FDWPVGQNIRKDCR-YJCCFKNTSA-N
Molecular Weight 377.528 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](\C=C\C(=C)CCc1ccccc1)(Cc1ccccc1)[H]
SPLASH splash10-0006-9000000000-1a873bfa3479328c98fa
Source of Spectrum KC-61-6798-15
Wiley ID 1629721