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5H-1,4-Dithiepin-2-propanal, 3-(acetyloxy)-6,7-dihydro-
SpectraBase Compound ID 195SMTBsVEv
InChI InChI=1S/C10H14O3S2/c1-8(12)13-10-9(4-2-5-11)14-6-3-7-15-10/h5H,2-4,6-7H2,1H3
InChIKey WRECAWNXGOOOPP-UHFFFAOYSA-N
Mol Weight 246.34 g/mol
Molecular Formula C10H14O3S2
Exact Mass 246.038437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H56sX0O9pjl
Name 5H-1,4-Dithiepin-2-propanal, 3-(acetyloxy)-6,7-dihydro-
CAS Registry Number 70068-07-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3S2
InChI InChI=1S/C10H14O3S2/c1-8(12)13-10-9(4-2-5-11)14-6-3-7-15-10/h5H,2-4,6-7H2,1H3
InChIKey WRECAWNXGOOOPP-UHFFFAOYSA-N
Molecular Weight 246.339 g/mol
SMILES C1(OC(=O)C)=C(SCCCS1)CCC=O
SPLASH splash10-000f-9230000000-c233fde3c1949a7a97ed
Source of Spectrum H-61-3095-0
Synonyms 3-(3-oxopropyl)-6,7-dihydro-5H-1,4-dithiepin-2-yl acetate 5-Acetoxy-4,5-trimethylenedithio-4-pentenal
Wiley ID 1248450