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3-Buten-1-ynylbenzene
SpectraBase Compound ID 4N6IHFuufnU
InChI InChI=1S/C10H8/c1-2-3-7-10-8-5-4-6-9-10/h2,4-6,8-9H,1H2
InChIKey GDELZQKEFMWYKA-UHFFFAOYSA-N
Mol Weight 128.17 g/mol
Molecular Formula C10H8
Exact Mass 128.0626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYRfkOLkhLg
Name 3-buten-1-ynylbenzene
CAS Registry Number 13633-26-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8
InChI InChI=1S/C10H8/c1-2-3-7-10-8-5-4-6-9-10/h2,4-6,8-9H,1H2
InChIKey GDELZQKEFMWYKA-UHFFFAOYSA-N
Molecular Weight 128.174 g/mol
SMILES C(#Cc1ccccc1)C=C
SPLASH splash10-004i-0900000000-10d7f060a5f5ddadbdb2
Source of Spectrum J-59-8149-5
Synonyms but-3-en-1-ynylbenzene
Wiley ID 1131932