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5-Phenylsulfanyl-2-methyl-7-nitroquinazoline-4(3H)-one

View entire compound with spectra: 1 MS (GC)

5-Phenylsulfanyl-2-methyl-7-nitroquinazoline-4(3H)-one
SpectraBase Compound ID 5C0sNgGqbf7
InChI InChI=1S/C15H11N3O3S/c1-9-16-12-7-10(18(20)21)8-13(14(12)15(19)17-9)22-11-5-3-2-4-6-11/h2-8H,1H3,(H,16,17,19)
InChIKey OHSRVCPWKZPPGL-UHFFFAOYSA-N
Mol Weight 313.33 g/mol
Molecular Formula C15H11N3O3S
Exact Mass 313.052112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtdKUv5GBa4
Name 5-Phenylsulfanyl-2-methyl-7-nitroquinazoline-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11N3O3S
InChI InChI=1S/C15H11N3O3S/c1-9-16-12-7-10(18(20)21)8-13(14(12)15(19)17-9)22-11-5-3-2-4-6-11/h2-8H,1H3,(H,16,17,19)
InChIKey OHSRVCPWKZPPGL-UHFFFAOYSA-N
Molecular Weight 313.331 g/mol
SMILES N1C(=Nc2c(C1=O)c(cc(c2)N(=O)=O)Sc1ccccc1)C
SPLASH splash10-03di-0119000000-f0ada65955793dc2c254
Source of Spectrum J-73-2290-9d
Wiley ID 1668071