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JSPNBERPFLONRX-VOTSOKGWSA-N
SpectraBase Compound ID AqndjCR0Jcr
InChI InChI=1S/C9H9NO2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-7H,1H3/b7-6+
InChIKey JSPNBERPFLONRX-VOTSOKGWSA-N
Mol Weight 163.18 g/mol
Molecular Formula C9H9NO2
Exact Mass 163.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0J8sRKnQtz
Name 1-Methyl-4-[(E)-2-nitroethenyl]benzene
CAS Registry Number 7559-36-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO2
InChI InChI=1S/C9H9NO2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-7H,1H3/b7-6+
InChIKey JSPNBERPFLONRX-VOTSOKGWSA-N
Molecular Weight 163.176 g/mol
SMILES c1(\C=C\N(=O)=O)ccc(cc1)C
SPLASH splash10-014l-5900000000-35e246259f1df0fe3984
Source of Spectrum F9-1990-1928-0
Synonyms 1-Methyl-4-[(E)-2-nitrovinyl]benzene
Wiley ID 1566303