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METHYL-2-(HEPT-1-YN-1-YL)-BENZOATE

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METHYL-2-(HEPT-1-YN-1-YL)-BENZOATE
SpectraBase Compound ID 8hXsDVK1Uv0
InChI InChI=1S/C15H18O2/c1-3-4-5-6-7-10-13-11-8-9-12-14(13)15(16)17-2/h8-9,11-12H,3-6H2,1-2H3
InChIKey MYICNXFAVYQNRG-UHFFFAOYSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5cVouSVbI4C
Name METHYL-2-(HEPT-1-YN-1-YL)-BENZOATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18O2
InChI InChI=1S/C15H18O2/c1-3-4-5-6-7-10-13-11-8-9-12-14(13)15(16)17-2/h8-9,11-12H,3-6H2,1-2H3
InChIKey MYICNXFAVYQNRG-UHFFFAOYSA-N
Literature Reference Author V.HAMPL,I.WETZEL,F.BRACHER,J.KRAUSS
Literature Reference Citation SCI.PHARM.,79,21(2011)
Literature Reference DOI 10.3797/scipharm.1011-10
Molecular Weight 230.307 g/mol
Sample ID 3044
Solvent CDCl3