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2H-Pyrrole, 3,4-dihydro-2-[1-(phenylthio)-1-propenyl]-, (E)-(.+-.)-
SpectraBase Compound ID D6hUTAUXbrV
InChI InChI=1S/C13H15NS/c1-2-13(12-9-6-10-14-12)15-11-7-4-3-5-8-11/h2-5,7-8,10,12H,6,9H2,1H3/b13-2+
InChIKey FDUBTCOICJHXJF-XNJYKOPJSA-N
Mol Weight 217.33 g/mol
Molecular Formula C13H15NS
Exact Mass 217.092521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ctYQ8secVl
Name 2H-Pyrrole, 3,4-dihydro-2-[1-(phenylthio)-1-propenyl]-, (E)-(.+-.)-
CAS Registry Number 128845-07-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NS
InChI InChI=1S/C13H15NS/c1-2-13(12-9-6-10-14-12)15-11-7-4-3-5-8-11/h2-5,7-8,10,12H,6,9H2,1H3/b13-2+
InChIKey FDUBTCOICJHXJF-XNJYKOPJSA-N
Molecular Weight 217.330 g/mol
SMILES c1(S\C(C2N=CCC2)=C/C)ccccc1
SPLASH splash10-05mo-4930000000-19d9aecd92a76f4e85ca
Source of Spectrum J-55-5728-14
Synonyms (1E)-1-(3,4-dihydro-2H-pyrrol-2-yl)-1-propenyl phenyl sulfide 2-[(1E)-1-(phenylsulfanyl)-1-propenyl]-3,4-dihydro-2H-pyrrole 5-[(E)-1-(phenylthio)-1-propenyl]-1-pyrroline
Wiley ID 1216743