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1-(4-([(E)-(6-Nitro-1,3-benzodioxol-5-yl)methylidene]amino)phenyl)ethanone
SpectraBase Compound ID KLjWoQFHJsk
InChI InChI=1S/C16H12N2O5/c1-10(19)11-2-4-13(5-3-11)17-8-12-6-15-16(23-9-22-15)7-14(12)18(20)21/h2-8H,9H2,1H3/b17-8+
InChIKey CMJLTOPBXIAGIA-CAOOACKPSA-N
Mol Weight 312.28 g/mol
Molecular Formula C16H12N2O5
Exact Mass 312.074621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXLg0ERotkc
Name 1-(4-([(E)-(6-Nitro-1,3-benzodioxol-5-yl)methylidene]amino)phenyl)ethanone
Alternate Name(s) Benzene, 1-(4-acetylphenyliminomethyl)-3,4-methylenedioxy-6-nitro-
CAS Registry Number 303759-45-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N2O5
InChI InChI=1S/C16H12N2O5/c1-10(19)11-2-4-13(5-3-11)17-8-12-6-15-16(23-9-22-15)7-14(12)18(20)21/h2-8H,9H2,1H3/b17-8+
InChIKey CMJLTOPBXIAGIA-CAOOACKPSA-N
Molecular Weight 312.281 g/mol
SMILES c1c(ccc(c1)\N=C\c1cc2c(cc1N(=O)=O)OCO2)C(C)=O
SPLASH splash10-0007-9620000000-30f992895f90ba94ed6d
Source of Spectrum AD-0-2532-0
Wiley ID 1425594