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p-Tolylacetylene
SpectraBase Compound ID 5orjWM48tj3
InChI InChI=1S/C9H8/c1-3-9-6-4-8(2)5-7-9/h1,4-7H,2H3
InChIKey KSZVOXHGCKKOLL-UHFFFAOYSA-N
Mol Weight 116.16 g/mol
Molecular Formula C9H8
Exact Mass 116.0626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DT4NQq98qzj
Name Benzene, 1-ethynyl-4-methyl-
Alternate Name(s) 1-Ethynyl-4-methylbenzene 4'-Methylphenylacetylene 4-Ethynyltoluene 4-Methylphenylacetylene p-Ethynyltoluene p-Methylphenylacetylene p-Tolylacetylene Toluene, p-ethynyl- BRN 0969653
CAS Registry Number 766-97-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8
InChI InChI=1S/C9H8/c1-3-9-6-4-8(2)5-7-9/h1,4-7H,2H3
InChIKey KSZVOXHGCKKOLL-UHFFFAOYSA-N
Molecular Weight 116.163 g/mol
SMILES C#Cc1ccc(cc1)C
SPLASH splash10-014i-1900000000-b2f283f0bc9028ba9dcf
Source of Spectrum EP-8621-0-0
Wiley ID 1126008