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Estragole

View entire compound with spectra: 17 NMR, 9 FTIR, 1 Raman, and 28 MS (GC)

Estragole
SpectraBase Compound ID HeHYHO0ieRL
InChI InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3
InChIKey ZFMSMUAANRJZFM-UHFFFAOYSA-N
Mol Weight 148.2 g/mol
Molecular Formula C10H12O
Exact Mass 148.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3QCukpIOO2b
Name 3-ALLYL-BENZOIC-ACID-ETHYL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12O
InChI InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3
InChIKey ZFMSMUAANRJZFM-UHFFFAOYSA-N
Literature Reference Author P.GOMES,C.GOSMINI,J.PERICHON
Literature Reference Citation ORG.LETTERS,5,1043(2003)
Literature Reference DOI 10.1021/ol0340641
Molecular Weight 148.205 g/mol
Sample ID 47416
Solvent Unknown