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2-Octynoic acid

View entire compound with spectra: 2 NMR, 4 FTIR, 2 Raman, 1 UV-Vis, and 2 MS (GC)

2-Octynoic acid
SpectraBase Compound ID GwyTWHYbXhZ
InChI InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H2,1H3,(H,9,10)
InChIKey BQDKCWCMDBMLEH-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID Fb2ixsh29oy
Name 2-Octynoic acid
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number B21957
Lot Number 10170784
CAS Registry Number 5663-96-7
Color Properties Colorless
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H2,1H3,(H,9,10)
InChIKey BQDKCWCMDBMLEH-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Molecular Weight 140.182 g/mol
Purity 98%
Sample Type Organic
Source of Spectrum Bio-Rad Laboratories, Inc.
Technique ATR-Neat (DuraSamplIR II)