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[(p-Nitrobenzylidene)cyano]acetic acid
SpectraBase Compound ID 7WRmjRfrgAX
InChI InChI=1S/C10H6N2O4/c11-6-8(10(13)14)5-7-1-3-9(4-2-7)12(15)16/h1-5H,(H,13,14)/b8-5+
InChIKey WVRIVHWJJWXSTM-VMPITWQZSA-N
Mol Weight 218.17 g/mol
Molecular Formula C10H6N2O4
Exact Mass 218.032757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91xeXLO1FKB
Name [(p-Nitrobenzylidene)cyano]acetic acid
Alternate Name(s) 2-Cyano-3-(4-nitrophenyl)-2-propenoic acid (E)-2-cyano-3-(4-nitrophenyl)-2-propenoic acid (E)-2-cyano-3-(4-nitrophenyl)acrylic acid (E)-2-cyano-3-(4-nitrophenyl)prop-2-enoic acid
CAS Registry Number 60951-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H6N2O4
InChI InChI=1S/C10H6N2O4/c11-6-8(10(13)14)5-7-1-3-9(4-2-7)12(15)16/h1-5H,(H,13,14)/b8-5+
InChIKey WVRIVHWJJWXSTM-VMPITWQZSA-N
Molecular Weight 218.168 g/mol
SMILES OC(\C(=C\c1ccc(N(=O)=O)cc1)C#N)=O
SPLASH splash10-000i-0900000000-453a494a1d2e9c489391
Source of Spectrum SK-28-4660-7
Wiley ID 880299