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4-Pentynoic acid
SpectraBase Compound ID E4AXuDsd66p
InChI InChI=1S/C5H6O2/c1-2-3-4-5(6)7/h1H,3-4H2,(H,6,7)
InChIKey MLBYLEUJXUBIJJ-UHFFFAOYSA-N
Mol Weight 98.1 g/mol
Molecular Formula C5H6O2
Exact Mass 98.036779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WaVcWIoLoV
Name 4-Pentynoic acid
Alternate Name(s) Pent-4-yn-1-oic acid Pent-4-ynoic acid Propargylacetic acid BRN 1742047 EINECS 228-028-0
CAS Registry Number 6089-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6O2
InChI InChI=1S/C5H6O2/c1-2-3-4-5(6)7/h1H,3-4H2,(H,6,7)
InChIKey MLBYLEUJXUBIJJ-UHFFFAOYSA-N
Molecular Weight 98.101 g/mol
SMILES OC(CCC#C)=O
SPLASH splash10-0kfw-9000000000-bc4efcea36f6fea4b43b
Source of Spectrum W5-1989-33160-32376
Wiley ID 1118562