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1H-Isoindol-1-imine, 5-(2,2-dimethylpropoxy)-3-(methylthio)-
SpectraBase Compound ID I1d4CxGVV12
InChI InChI=1S/C14H18N2OS/c1-14(2,3)8-17-9-5-6-10-11(7-9)13(18-4)16-12(10)15/h5-7,15H,8H2,1-4H3
InChIKey MTQIZMNRDBUECY-UHFFFAOYSA-N
Mol Weight 262.37 g/mol
Molecular Formula C14H18N2OS
Exact Mass 262.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zT2QSsrzUW
Name 1H-Isoindol-1-imine, 5-(2,2-dimethylpropoxy)-3-(methylthio)-
CAS Registry Number 117052-57-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N2OS
InChI InChI=1S/C14H18N2OS/c1-14(2,3)8-17-9-5-6-10-11(7-9)13(18-4)16-12(10)15/h5-7,15H,8H2,1-4H3
InChIKey MTQIZMNRDBUECY-UHFFFAOYSA-N
Molecular Weight 262.371 g/mol
SMILES N=C1N=C(c2cc(OCC(C)(C)C)ccc12)SC
SPLASH splash10-006y-9440000000-24544c7c20a9628d829a
Source of Spectrum I-66-1063-12
Synonyms 5-(2,2-dimethylpropoxy)-3-(methylthio)-1-isoindolimine 5-(2,2-dimethylpropoxy)-3-methylsulfanylisoindol-1-imine 5-(2,2-dimethylpropoxy)-3-methylsulfanyl-isoindol-1-imine
Wiley ID 1265707