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2-[(E,1R)-1-methylbut-2-enyl]sulfanylpyrimidine
SpectraBase Compound ID 3ZOzw07cjlG
InChI InChI=1S/C9H12N2S/c1-3-5-8(2)12-9-10-6-4-7-11-9/h3-8H,1-2H3/b5-3+/t8-/m1/s1
InChIKey DZJACXOBMVJLIJ-RYEJSQLPSA-N
Mol Weight 180.27 g/mol
Molecular Formula C9H12N2S
Exact Mass 180.07212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hRiSYIsq0
Name 2-[(E,1R)-1-methylbut-2-enyl]sulfanylpyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N2S
InChI InChI=1S/C9H12N2S/c1-3-5-8(2)12-9-10-6-4-7-11-9/h3-8H,1-2H3/b5-3+/t8-/m1/s1
InChIKey DZJACXOBMVJLIJ-RYEJSQLPSA-N
Molecular Weight 180.269 g/mol
SMILES c1(ncccn1)S[C@@](\C=C\C)(C)[H]
SPLASH splash10-0gb9-9800000000-f5227f5d974908ed5130
Source of Spectrum QF-9-4216-6
Synonyms 2-[(E,2R)-pent-3-en-2-yl]sulfanylpyrimidine 2-[[(E,1R)-1-methylbut-2-enyl]thio]pyrimidine 2-[[(E,2R)-pent-3-en-2-yl]thio]pyrimidine
Wiley ID 1558804