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Ethyl N-(13-bromo-12,19-dimethoxypodocarpa-8,11,13-trien-14-yl)carbamate
SpectraBase Compound ID 8aYnaotrSGR
InChI InChI=1S/C22H32BrNO4/c1-6-28-20(25)24-19-14-8-9-17-21(2,13-26-4)10-7-11-22(17,3)15(14)12-16(27-5)18(19)23/h12,17H,6-11,13H2,1-5H3,(H,24,25)/t17?,21-,22-/m1/s1
InChIKey HGBYOXRFPCNLSW-TWBYEDGTSA-N
Mol Weight 454.4 g/mol
Molecular Formula C22H32BrNO4
Exact Mass 453.151472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AUXKHFU30Ws
Name Ethyl N-(13-bromo-12,19-dimethoxypodocarpa-8,11,13-trien-14-yl)carbamate
Alternate Name(s) (4S,10S)-ethyl N-(13-bromo-12,19-dimethoxypodocarpa-8,11,13-trien-14-yl)carbamate Ethyl (4beta)-13-bromo-12,15-dimethoxypodocarpa-8,11,13-trien-14-ylcarbamate Ethyl N-[(4bS,8S)-2-bromo-3-methoxy-8-(methoxymethyl)-4b,8-dimethyl-5,6,7,8a,9,10-hexahydrophenanthren-1-yl]carbamate Ethyl N-[(4bS,8S)-2-bromanyl-3-methoxy-8-(methoxymethyl)-4b,8-dimethyl-5,6,7,8a,9,10-hexahydrophenanthren-1-yl]carbamate
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Formula C22H32BrNO4
InChI InChI=1S/C22H32BrNO4/c1-6-28-20(25)24-19-14-8-9-17-21(2,13-26-4)10-7-11-22(17,3)15(14)12-16(27-5)18(19)23/h12,17H,6-11,13H2,1-5H3,(H,24,25)/t17?,21-,22-/m1/s1
InChIKey HGBYOXRFPCNLSW-TWBYEDGTSA-N
Molecular Weight 454.405 g/mol
SMILES N(c1c2c([C@@]3(C([C@](COC)(C)CCC3)CC2)C)cc(c1Br)OC)C(=O)OCC
SPLASH splash10-0ab9-0027900000-a98817ee175f516ff6f6
Source of Spectrum B-47-1483-0
Wiley ID 1388482