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Phenylacetylene
SpectraBase Compound ID LT7ezgKWXCi
InChI InChI=1S/C8H6/c1-2-8-6-4-3-5-7-8/h1,3-7H
InChIKey UEXCJVNBTNXOEH-UHFFFAOYSA-N
Mol Weight 102.14 g/mol
Molecular Formula C8H6
Exact Mass 102.04695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5KttrM4YKM
Name Benzene, ethynyl-
Alternate Name(s) 1-Phenylethyne Acetylene, phenyl- Ethinylbenzene Ethyne, phenyl- Ethynyl-benzene (phenylacetylene) Ethynylbenzene Phenylacethylene Phenylacetylene Phenylacetylide Phenylethyne AI3-24180 EINECS 208-645-1 NSC 4957
CAS Registry Number 536-74-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6
InChI InChI=1S/C8H6/c1-2-8-6-4-3-5-7-8/h1,3-7H
InChIKey UEXCJVNBTNXOEH-UHFFFAOYSA-N
Molecular Weight 102.136 g/mol
SMILES C#Cc1ccccc1
SPLASH splash10-0udi-4900000000-8e1ec2c430f5e09f5ea8
Source of Spectrum PR-1553-0-0
Wiley ID 1120719