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XFCGMIGOOIZCKE-NSCUHMNNSA-N
SpectraBase Compound ID 7hvX0yFEiYW
InChI InChI=1S/C12H10OS/c1-2-3-4-5-6-7-11-8-9-12(10-13)14-11/h2-3,8-9,13H,10H2,1H3/b3-2+
InChIKey XFCGMIGOOIZCKE-NSCUHMNNSA-N
Mol Weight 202.27 g/mol
Molecular Formula C12H10OS
Exact Mass 202.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3K54Axi5SN8
Name 5-(Hydroxymethyl)-2-hept-5-ene-1,3-diynylthiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10OS
InChI InChI=1S/C12H10OS/c1-2-3-4-5-6-7-11-8-9-12(10-13)14-11/h2-3,8-9,13H,10H2,1H3/b3-2+
InChIKey XFCGMIGOOIZCKE-NSCUHMNNSA-N
Molecular Weight 202.271 g/mol
SMILES OCc1sc(C#CC#C\C=C\C)cc1
SPLASH splash10-0udi-0390000000-811d82531812fc4ff905
Source of Spectrum G4-69-1243-4
Synonyms [5-[(E)-hept-5-en-1,3-diynyl]-2-thiophenyl]methanol [5-[(E)-hept-5-en-1,3-diynyl]thiophen-2-yl]methanol
Wiley ID 1694483