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(E)-2-nitro-5-phenyl-4-pentene-1,3-diol
SpectraBase Compound ID 71F1snMjidZ
InChI InChI=1S/C11H13NO4/c13-8-10(12(15)16)11(14)7-6-9-4-2-1-3-5-9/h1-7,10-11,13-14H,8H2/b7-6+
InChIKey CNNKFFCRISRNFG-VOTSOKGWSA-N
Mol Weight 223.23 g/mol
Molecular Formula C11H13NO4
Exact Mass 223.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ds08OIV6Uhr
Name (E)-2-nitro-5-phenyl-4-pentene-1,3-diol
CAS Registry Number 96040-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO4
InChI InChI=1S/C11H13NO4/c13-8-10(12(15)16)11(14)7-6-9-4-2-1-3-5-9/h1-7,10-11,13-14H,8H2/b7-6+
InChIKey CNNKFFCRISRNFG-VOTSOKGWSA-N
Molecular Weight 223.228 g/mol
SMILES OC(C(CO)N(=O)=O)\C=C\c1ccccc1
SPLASH splash10-0f89-4900000000-19d04818f06bc96dcdb4
Source of Spectrum C-107-3605-0
Synonyms (E)-2-nitro-5-phenyl-pent-4-ene-1,3-diol
Wiley ID 1223873