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(E)-4-(1,3-dithian-2-yl)-4-hept-2-en-5-ynol

View entire compound with spectra: 1 MS (GC)

(E)-4-(1,3-dithian-2-yl)-4-hept-2-en-5-ynol
SpectraBase Compound ID 1IYyrV3o3WI
InChI InChI=1S/C11H16OS2/c1-3-6-11(12,7-4-2)10-13-8-5-9-14-10/h3,6,10,12H,5,8-9H2,1-2H3/b6-3+
InChIKey AVQJTVXWKCLWSF-ZZXKWVIFSA-N
Mol Weight 228.37 g/mol
Molecular Formula C11H16OS2
Exact Mass 228.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BGA8785N3b
Name (E)-4-(1,3-dithian-2-yl)-4-hept-2-en-5-ynol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16OS2
InChI InChI=1S/C11H16OS2/c1-3-6-11(12,7-4-2)10-13-8-5-9-14-10/h3,6,10,12H,5,8-9H2,1-2H3/b6-3+
InChIKey AVQJTVXWKCLWSF-ZZXKWVIFSA-N
Molecular Weight 228.368 g/mol
SMILES OC(C#CC)(C1SCCCS1)\C=C\C
SPLASH splash10-014l-6900000000-26d64ca01d2472687c9d
Source of Spectrum J-63-5286-0
Synonyms (E)-4-(1,3-dithian-2-yl)hept-2-en-5-yn-4-ol
Wiley ID 1229348