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Benzyl (2S)-2-(tert-Butoxycarbonylamino)hept-5,6-dienoate
SpectraBase Compound ID BsEgv4teo0s
InChI InChI=1S/C19H25NO4/c1-5-6-8-13-16(20-18(22)24-19(2,3)4)17(21)23-14-15-11-9-7-10-12-15/h6-7,9-12,16H,1,8,13-14H2,2-4H3,(H,20,22)/t16-/m0/s1
InChIKey KWFMZIDSAYKRMO-INIZCTEOSA-N
Mol Weight 331.41 g/mol
Molecular Formula C19H25NO4
Exact Mass 331.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENxm8M0XOdC
Name Benzyl (2S)-2-(tert-Butoxycarbonylamino)hept-5,6-dienoate
Alternate Name(s) benzyl (2S)-2-[(tert-butoxycarbonyl)amino]-5,6-heptadienoate
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Formula C19H25NO4
InChI InChI=1S/C19H25NO4/c1-5-6-8-13-16(20-18(22)24-19(2,3)4)17(21)23-14-15-11-9-7-10-12-15/h6-7,9-12,16H,1,8,13-14H2,2-4H3,(H,20,22)/t16-/m0/s1
InChIKey KWFMZIDSAYKRMO-INIZCTEOSA-N
Molecular Weight 331.412 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@](C(OCc1ccccc1)=O)(CCC=C=C)[H]
SPLASH splash10-001i-0292000000-db13d4ec04cd2b35447d
Source of Spectrum KC-0-1907-13
Wiley ID 825706