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(4R*)-Methyl 4-(Benzyloxy)-3-bromo-2-(N-(methoxycarbonyl)amino]-5-methyl-2(E)-hexenoate
SpectraBase Compound ID H4Rty0bnF9G
InChI InChI=1S/C17H22BrNO5/c1-11(2)15(24-10-12-8-6-5-7-9-12)13(18)14(16(20)22-3)19-17(21)23-4/h5-9,11,15H,10H2,1-4H3,(H,19,21)/b14-13+/t15-/m1/s1
InChIKey FSYFHKLHHZLSPQ-SZGUKTLCSA-N
Mol Weight 400.27 g/mol
Molecular Formula C17H22BrNO5
Exact Mass 399.068136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DvB3wCTxFl0
Name (4R*)-Methyl 4-(Benzyloxy)-3-bromo-2-(N-(methoxycarbonyl)amino]-5-methyl-2(E)-hexenoate
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Formula C17H22BrNO5
InChI InChI=1S/C17H22BrNO5/c1-11(2)15(24-10-12-8-6-5-7-9-12)13(18)14(16(20)22-3)19-17(21)23-4/h5-9,11,15H,10H2,1-4H3,(H,19,21)/b14-13+/t15-/m1/s1
InChIKey FSYFHKLHHZLSPQ-SZGUKTLCSA-N
Molecular Weight 400.269 g/mol
SMILES N(\C(=C/([C@](OCc1ccccc1)(C(C)C)[H])Br)C(=O)OC)C(=O)OC
SPLASH splash10-0006-9112000000-6d756494f444b5619d04
Source of Spectrum J-58-4460-8
Synonyms Methyl (2E,4R)-4-(benzyloxy)-3-bromo-2-[(methoxycarbonyl)amino]-5-methyl-2-hexenoate
Wiley ID 1368880