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(E)-4,6-Dichloro-5-(2S,6R)-(6-styryltetrahydro-2H-pyran-2-yl)pyrimidine
SpectraBase Compound ID WsZjw0klvw
InChI InChI=1S/C17H16Cl2N2O/c18-16-15(17(19)21-11-20-16)14-8-4-7-13(22-14)10-9-12-5-2-1-3-6-12/h1-3,5-6,9-11,13-14H,4,7-8H2/b10-9+/t13-,14+/m1/s1
InChIKey QMGGJFVIOIJVPJ-HOQBHHMFSA-N
Mol Weight 335.23 g/mol
Molecular Formula C17H16Cl2N2O
Exact Mass 334.063969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yilIzMariS
Name (E)-4,6-Dichloro-5-(2S,6R)-(6-styryltetrahydro-2H-pyran-2-yl)pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16Cl2N2O
InChI InChI=1S/C17H16Cl2N2O/c18-16-15(17(19)21-11-20-16)14-8-4-7-13(22-14)10-9-12-5-2-1-3-6-12/h1-3,5-6,9-11,13-14H,4,7-8H2/b10-9+/t13-,14+/m1/s1
InChIKey QMGGJFVIOIJVPJ-HOQBHHMFSA-N
Literature Reference DOI 10.1021/acs.joc.5b02371
Molecular Weight 335.234 g/mol
SMILES [C@@]1(CCC[C@@](O1)(\C=C\c1ccccc1)[H])(c1c(ncnc1Cl)Cl)[H]
SPLASH splash10-0udi-0900000000-27338f344a624d26bde2
Source of Spectrum J-80-12522-18c
Synonyms 4,6-Dichloro-5-((2S,6R)-6-((E)-styryl)tetrahydro-2H-pyran-2-yl)pyrimidine
Wiley ID 1801820