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2-(t-Butoxycarbonyl)-3-ethyl-4-vinyl-3,4-dihydro-1(2H)-isoquinolinone
SpectraBase Compound ID JO3aNEBTaiX
InChI InChI=1S/C18H23NO3/c1-6-12-13-10-8-9-11-14(13)16(20)19(15(12)7-2)17(21)22-18(3,4)5/h6,8-12,15H,1,7H2,2-5H3/t12-,15+/m1/s1
InChIKey DUBWRFCQWOFHIW-DOMZBBRYSA-N
Mol Weight 301.39 g/mol
Molecular Formula C18H23NO3
Exact Mass 301.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YjOR6hXLrC
Name 2-(t-Butoxycarbonyl)-3-ethyl-4-vinyl-3,4-dihydro-1(2H)-isoquinolinone
Alternate Name(s) (3S,4R)-2-(t-Butoxycarbonyl)-3-ethyl-4-vinyl-3,4-dihydro-1(2H)-isoquinolinone tert-Butyl 3-ethyl-1-oxo-4-vinyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate
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Formula C18H23NO3
InChI InChI=1S/C18H23NO3/c1-6-12-13-10-8-9-11-14(13)16(20)19(15(12)7-2)17(21)22-18(3,4)5/h6,8-12,15H,1,7H2,2-5H3/t12-,15+/m1/s1
InChIKey DUBWRFCQWOFHIW-DOMZBBRYSA-N
Molecular Weight 301.386 g/mol
SMILES C1(N([C@]([C@@](c2ccccc12)(C=C)[H])(CC)[H])C(OC(C)(C)C)=O)=O
SPLASH splash10-0596-3910000000-81fea4bfde471ea03472
Source of Spectrum U-1995-1156-5
Wiley ID 767155