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Isosafrole

View entire compound with spectra: 1 NMR

Isosafrole
SpectraBase Compound ID 7KwyaXbWq2Y
InChI InChI=1S/2C10H10O2/c2*1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2*2-6H,7H2,1H3
InChIKey RMNWUXPEDRCTHB-UHFFFAOYSA-N
Mol Weight 324.38 g/mol
Molecular Formula C20H20O4
Exact Mass 324.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JSEdWHNTYoi
Name 1,2-(METHYLENEDIOXY)-4-PROPENYLBENZENE
Source of Sample Eastman Organic Chemicals, Rochester, New York
Boiling Point 248C
Comments Tentative assignments
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2
InChI InChI=1S/2C10H10O2/c2*1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2*2-6H,7H2,1H3
InChIKey RMNWUXPEDRCTHB-UHFFFAOYSA-N
Melting Point 6.8C
Molecular Weight 162.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ISOSAFROLE