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2,4,6-Heptatrienoic acid, 7-(4-hydroxy-3-nitrophenyl)-, (E,E,E)-
SpectraBase Compound ID 5gp5r7pgSpf
InChI InChI=1S/C13H11NO5/c15-12-8-7-10(9-11(12)14(18)19)5-3-1-2-4-6-13(16)17/h1-9,15H,(H,16,17)/b2-1+,5-3+,6-4+
InChIKey AROXMXQIWQDPQK-CRQXNEITSA-N
Mol Weight 261.23 g/mol
Molecular Formula C13H11NO5
Exact Mass 261.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FV8JR0Q2487
Name 2,4,6-Heptatrienoic acid, 7-(4-hydroxy-3-nitrophenyl)-, (E,E,E)-
CAS Registry Number 105183-13-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO5
InChI InChI=1S/C13H11NO5/c15-12-8-7-10(9-11(12)14(18)19)5-3-1-2-4-6-13(16)17/h1-9,15H,(H,16,17)/b2-1+,5-3+,6-4+
InChIKey AROXMXQIWQDPQK-CRQXNEITSA-N
Molecular Weight 261.233 g/mol
SMILES OC(\C=C\C=C\C=C\c1cc(c(cc1)O)N(=O)=O)=O
SPLASH splash10-02t9-0890000000-d2cdd0b3a7efef1460f2
Source of Spectrum C-108-8254-14
Synonyms (2E,4E,6E)-7-(4-hydroxy-3-nitrophenyl)-2,4,6-heptatrienoic acid 7-(3-Nitro-4-hydroxyphenyl)hepta-2,4,6-treinoic acid
Wiley ID 1264630