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object
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_id
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1HBJPc9KqeU
spectrumID
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1HBJPc9KqeU
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Methyl 6-chloro-5-formyl-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
SpectraBase Compound ID Bw5XptjEEPX
InChI InChI=1S/C15H13ClN2O5/c1-8-12(15(20)23-2)13(11(7-19)14(16)17-8)9-4-3-5-10(6-9)18(21)22/h3-7,13,17H,1-2H3
InChIKey MKEMTXYUMOSERT-UHFFFAOYSA-N
Mol Weight 336.73 g/mol
Molecular Formula C15H13ClN2O5
Exact Mass 336.051299 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HBJPc9KqeU
Name Methyl 6-chloro-5-formyl-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13ClN2O5
InChI InChI=1S/C15H13ClN2O5/c1-8-12(15(20)23-2)13(11(7-19)14(16)17-8)9-4-3-5-10(6-9)18(21)22/h3-7,13,17H,1-2H3
InChIKey MKEMTXYUMOSERT-UHFFFAOYSA-N
Molecular Weight 336.731 g/mol
SMILES N1C(=C(C(C(=C1Cl)C=O)c1cc(N(=O)=O)ccc1)C(=O)OC)C
SPLASH splash10-03di-0292000000-8ee5555f89d202731677
Source of Spectrum KC-0-950-2
Synonyms 6-Chloro-5-formyl-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Methyl 6-chloranyl-5-methanoyl-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
Wiley ID 785601
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