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Ethyl cis-2,4-bis-(3-nitrophenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
SpectraBase Compound ID 5GI9sTYjjV2
InChI InChI=1S/C20H20N4O6/c1-3-30-20(25)17-12(2)21-19(14-7-5-9-16(11-14)24(28)29)22-18(17)13-6-4-8-15(10-13)23(26)27/h4-11,18-19,21-22H,3H2,1-2H3/t18-,19+/m1/s1
InChIKey LYSZPSRFMMSDIP-MOPGFXCFSA-N
Mol Weight 412.4 g/mol
Molecular Formula C20H20N4O6
Exact Mass 412.138284 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mgm3xe4FHQ
Name Ethyl cis-2,4-bis-(3-nitrophenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N4O6
InChI InChI=1S/C20H20N4O6/c1-3-30-20(25)17-12(2)21-19(14-7-5-9-16(11-14)24(28)29)22-18(17)13-6-4-8-15(10-13)23(26)27/h4-11,18-19,21-22H,3H2,1-2H3/t18-,19+/m1/s1
InChIKey LYSZPSRFMMSDIP-MOPGFXCFSA-N
Molecular Weight 412.402 g/mol
SMILES N1[C@@](C(=C(N[C@@]1(c1cc(ccc1)[N+](=O)[O-])[H])C)C(=O)OCC)(c1cc(ccc1)[N+](=O)[O-])[H]
SPLASH splash10-03di-0092000000-4a6177fff84a5c32f0ec
Source of Spectrum APC-322-256-6b
Synonyms Ethyl (2R,4R)-6-methyl-2,4-bis(3-nitrophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Wiley ID 1788572