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1,3-Benzodithiolane, 4-methyl-2-(3-methylbutyl)oxy-
SpectraBase Compound ID 4lhxp28MDzr
InChI InChI=1S/C13H18OS2/c1-9(2)7-8-14-13-15-11-6-4-5-10(3)12(11)16-13/h4-6,9,13H,7-8H2,1-3H3
InChIKey AIHXRJNQKPBPLR-UHFFFAOYSA-N
Mol Weight 254.41 g/mol
Molecular Formula C13H18OS2
Exact Mass 254.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xHTSLw8TFm
Name 1,3-Benzodithiolane, 4-methyl-2-(3-methylbutyl)oxy-
CAS Registry Number 67855-54-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18OS2
InChI InChI=1S/C13H18OS2/c1-9(2)7-8-14-13-15-11-6-4-5-10(3)12(11)16-13/h4-6,9,13H,7-8H2,1-3H3
InChIKey AIHXRJNQKPBPLR-UHFFFAOYSA-N
Molecular Weight 254.406 g/mol
SMILES c1c2SC(Sc2c(cc1)C)OCCC(C)C
SPLASH splash10-014i-3910000000-6b552880a6e875f8e308
Synonyms 2-isoamoxy-4-methyl-1,3-benzodithiole 2-isopentyloxy-4-methyl-1,3-benzodithiole 4-Methyl-2-(3-methylbutoxy)-1,3-benzodithiole
Wiley ID 1490716