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4-Pyrimidinol, 2-amino-1,4,5,6-tetrahydro-4-(4-nitrophenyl)-6-phenyl-
SpectraBase Compound ID KcR8z5LLtKK
InChI InChI=1S/C16H16N4O3/c17-15-18-14(11-4-2-1-3-5-11)10-16(21,19-15)12-6-8-13(9-7-12)20(22)23/h1-9,14,21H,10H2,(H3,17,18,19)
InChIKey NZBNZSMAOPUYJV-UHFFFAOYSA-N
Mol Weight 312.33 g/mol
Molecular Formula C16H16N4O3
Exact Mass 312.12224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SVy7dZS97
Name 4-Pyrimidinol, 2-amino-1,4,5,6-tetrahydro-4-(4-nitrophenyl)-6-phenyl-
Alternate Name(s) 2-Amino-4-(4-nitrophenyl)-6-phenyl-3,4,5,6-tetrahydro-4-pyrimidinol
CAS Registry Number 91545-80-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N4O3
InChI InChI=1S/C16H16N4O3/c17-15-18-14(11-4-2-1-3-5-11)10-16(21,19-15)12-6-8-13(9-7-12)20(22)23/h1-9,14,21H,10H2,(H3,17,18,19)
InChIKey NZBNZSMAOPUYJV-UHFFFAOYSA-N
Molecular Weight 312.329 g/mol
SMILES N1C(=NC(CC1(c1ccc(N(=O)=O)cc1)O)c1ccccc1)N
SPLASH splash10-0udi-4490000000-c2c50be40666b5153795
Source of Spectrum AH-115-324-0
Wiley ID 1313109