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(2Z,5R,6E)-7-(4-Nitrophenyl)hepta-2,6-diene-1,5-diol
SpectraBase Compound ID KrUPOHfNoo7
InChI InChI=1S/C13H15NO4/c15-10-2-1-3-13(16)9-6-11-4-7-12(8-5-11)14(17)18/h1-2,4-9,13,15-16H,3,10H2/b2-1-,9-6+/t13-/m1/s1
InChIKey OEUABUUXGDGXIR-OJZWKQAVSA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPpf1jD8dqI
Name (2Z,5R,6E)-7-(4-Nitrophenyl)hepta-2,6-diene-1,5-diol
Alternate Name(s) (R,2Z,6E)-7-(4-nitrophenyl)hepta-2,6-diene-1,5-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c15-10-2-1-3-13(16)9-6-11-4-7-12(8-5-11)14(17)18/h1-2,4-9,13,15-16H,3,10H2/b2-1-,9-6+/t13-/m1/s1
InChIKey OEUABUUXGDGXIR-OJZWKQAVSA-N
Molecular Weight 249.266 g/mol
SMILES O[C@](C\C=C/CO)(\C=C\c1ccc(N(=O)=O)cc1)[H]
SPLASH splash10-0059-5900000000-2a1856586552337d1384
Source of Spectrum F4-45-1110-13
Wiley ID 1734279