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Heptanal, 2-(1,3-dithian-2-ylidene)-

View entire compound with spectra: 1 MS (GC)

Heptanal, 2-(1,3-dithian-2-ylidene)-
SpectraBase Compound ID 9x6BJadjpMj
InChI InChI=1S/C11H18OS2/c1-2-3-4-6-10(9-12)11-13-7-5-8-14-11/h9H,2-8H2,1H3
InChIKey KSOKGUKCWJKTIX-UHFFFAOYSA-N
Mol Weight 230.38 g/mol
Molecular Formula C11H18OS2
Exact Mass 230.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LlCjr0fUL60
Name Heptanal, 2-(1,3-dithian-2-ylidene)-
Alternate Name(s) 2-(1,3-dithian-2-ylidene)heptanal
CAS Registry Number 100189-92-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18OS2
InChI InChI=1S/C11H18OS2/c1-2-3-4-6-10(9-12)11-13-7-5-8-14-11/h9H,2-8H2,1H3
InChIKey KSOKGUKCWJKTIX-UHFFFAOYSA-N
Molecular Weight 230.384 g/mol
SMILES C1(=C(C=O)CCCCC)SCCCS1
SPLASH splash10-00di-1920000000-cd1ea07b18e6a97ea31d
Source of Spectrum J-51-941-5
Wiley ID 1231435