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6-Heptynoic acid

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 MS (GC)

6-Heptynoic acid
SpectraBase Compound ID 9EyHlgvBBte
InChI InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h1H,3-6H2,(H,8,9)
InChIKey OFCPMJGTZUVUSM-UHFFFAOYSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4PTY05mlGUC
Name 6-Heptynoic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 442879
CAS Registry Number 30964-00-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h1H,3-6H2,(H,8,9)
InChIKey OFCPMJGTZUVUSM-UHFFFAOYSA-N
Observed nucleus 13C
Purity 90%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_009738