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4-(but-3-en-1-yn-1-yl)-2-chloro-1-fluorobenzene
SpectraBase Compound ID E93WTdAPRrE
InChI InChI=1S/C10H6ClF/c1-2-3-4-8-5-6-10(12)9(11)7-8/h2,5-7H,1H2
InChIKey QYIZEENWZUKPDX-UHFFFAOYSA-N
Mol Weight 180.61 g/mol
Molecular Formula C10H6ClF
Exact Mass 180.014206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzrHpeZlyCm
Name 4-(but-3-en-1-yn-1-yl)-2-chloro-1-fluorobenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 180.014206056 u
Formula C10H6ClF
InChI InChI=1S/C10H6ClF/c1-2-3-4-8-5-6-10(12)9(11)7-8/h2,5-7H,1H2
InChIKey QYIZEENWZUKPDX-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202421
Molecular Weight 180.609 g/mol
Quality 242
SMILES C(#CC=C)C1=CC(=C(C=C1)F)Cl
SPLASH splash10-001i-0900000000-812f669796d9704fbfc6
Source of Spectrum QE-28-SM13-3a (DOI: 10.1002/chem.202202421)
Wiley ID 1900757