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tert-Butyl propiolate

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

tert-Butyl propiolate
SpectraBase Compound ID CHCfA6nVoK
InChI InChI=1S/C7H10O2/c1-5-6(8)9-7(2,3)4/h1H,2-4H3
InChIKey XGTPDIIFEPTULX-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 3avV3pkGIHn
Name tert-Butyl propiolate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 419885
CAS Registry Number 13831-03-3
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/c1-5-6(8)9-7(2,3)4/h1H,2-4H3
InChIKey XGTPDIIFEPTULX-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms tert-Butyl acetylenecarboxylate
Wiley ID SIAL_13CNMR_009308