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Hexahydro-2-[nitro(4-methylbenzoyl)methylene]pyrimidine
SpectraBase Compound ID CG69rJgefSA
InChI InChI=1S/C13H15N3O3/c1-9-3-5-10(6-4-9)12(17)11(16(18)19)13-14-7-2-8-15-13/h3-6,14-15H,2,7-8H2,1H3
InChIKey NOJSKBQZHLINQP-UHFFFAOYSA-N
Mol Weight 261.28 g/mol
Molecular Formula C13H15N3O3
Exact Mass 261.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yrJzDQR6AH
Name Hexahydro-2-[nitro(4-methylbenzoyl)methylene]pyrimidine
Alternate Name(s) 1-(4-Methylphenyl)-2-nitro-2-tetrahydro-2(1H)-pyrimidinylideneethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15N3O3
InChI InChI=1S/C13H15N3O3/c1-9-3-5-10(6-4-9)12(17)11(16(18)19)13-14-7-2-8-15-13/h3-6,14-15H,2,7-8H2,1H3
InChIKey NOJSKBQZHLINQP-UHFFFAOYSA-N
Molecular Weight 261.281 g/mol
SMILES N1CCCNC1=C(N(=O)=O)C(c1ccc(cc1)C)=O
SPLASH splash10-004i-0910000000-12f6df96d86b352c7460
Source of Spectrum SO-0-233-7
Wiley ID 876235