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(E)-Methyl 5-hydroxy-4-nitro-7-phenylhept-6-enoate
SpectraBase Compound ID 4Mj6v8df4jX
InChI InChI=1S/C14H17NO5/c1-20-14(17)10-8-12(15(18)19)13(16)9-7-11-5-3-2-4-6-11/h2-7,9,12-13,16H,8,10H2,1H3/b9-7+/t12-,13-/m0/s1
InChIKey USFRHJSRLSZLGB-VOWYIILJSA-N
Mol Weight 279.29 g/mol
Molecular Formula C14H17NO5
Exact Mass 279.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yVNEyfVszU
Name (E)-Methyl 5-hydroxy-4-nitro-7-phenylhept-6-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO5
InChI InChI=1S/C14H17NO5/c1-20-14(17)10-8-12(15(18)19)13(16)9-7-11-5-3-2-4-6-11/h2-7,9,12-13,16H,8,10H2,1H3/b9-7+/t12-,13-/m0/s1
InChIKey USFRHJSRLSZLGB-VOWYIILJSA-N
Literature Reference DOI 10.1021/ol1010888
Molecular Weight 279.292 g/mol
SMILES O[C@]([C@](CCC(OC)=O)([N+](=O)[O-])[H])(\C=C\c1ccccc1)[H]
SPLASH splash10-053r-8900000000-cbc86d98a02d65dd4844
Source of Spectrum A1-12-3058/SMS8-3j_Synisomer
Synonyms (4S,5S,E)-methyl 5-hydroxy-4-nitro-7-phenylhept-6-enoate
Wiley ID 1752333