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5-chloranyl-2-[(3-methylphenyl)sulfanylmethoxy]pyrimidine
SpectraBase Compound ID AjkwCBe1kdO
InChI InChI=1S/C12H11ClN2OS/c1-9-3-2-4-11(5-9)17-8-16-12-14-6-10(13)7-15-12/h2-7H,8H2,1H3
InChIKey ZVKWVHBDDLXESD-UHFFFAOYSA-N
Mol Weight 266.75 g/mol
Molecular Formula C12H11ClN2OS
Exact Mass 266.028062 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tlBANfY28k
Name 5-chloranyl-2-[(3-methylphenyl)sulfanylmethoxy]pyrimidine
CAS Registry Number 83768-12-1
Comments Less than 3 mono-isotopic peaks
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Formula C12H11ClN2OS
InChI InChI=1S/C12H11ClN2OS/c1-9-3-2-4-11(5-9)17-8-16-12-14-6-10(13)7-15-12/h2-7H,8H2,1H3
InChIKey ZVKWVHBDDLXESD-UHFFFAOYSA-N
Molecular Weight 266.746 g/mol
SMILES c1(ncc(cn1)Cl)OCSc1cc(C)ccc1
SPLASH splash10-000i-0910000000-94818448986613697c6f
Source of Spectrum Y-22-1079-4
Synonyms 5-chloro-2-(m-tolylsulfanylmethoxy)pyrimidine 5-chloro-2-[(m-tolylthio)methoxy]pyrimidine 5-chloro-2-[[(3-methylphenyl)thio]methoxy]pyrimidine
Wiley ID 1269545