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Benzoic acid, 1-propynyl ester
SpectraBase Compound ID 1Mys3hJwZv2
InChI InChI=1S/C10H8O2/c1-2-8-12-10(11)9-6-4-3-5-7-9/h3-7H,1H3
InChIKey YGTXEOIHUWEJAR-UHFFFAOYSA-N
Mol Weight 160.17 g/mol
Molecular Formula C10H8O2
Exact Mass 160.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEOedKbacO1
Name benzoic acid prop-1-ynyl ester
CAS Registry Number 112270-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8O2
InChI InChI=1S/C10H8O2/c1-2-8-12-10(11)9-6-4-3-5-7-9/h3-7H,1H3
InChIKey YGTXEOIHUWEJAR-UHFFFAOYSA-N
Molecular Weight 160.172 g/mol
SMILES C(=O)(c1ccccc1)OC#CC
SPLASH splash10-0a6r-5900000000-ae6d031af231ee430d37
Source of Spectrum C-110-3274-6
Synonyms Prop-1-ynyl benzoate Propynyl benzoate
Wiley ID 1157018