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Safrole

View entire compound with spectra: 16 NMR, 9 FTIR, 1 Raman, 1 UV-Vis, 40 MS (GC), and 2 Near IR

Safrole
SpectraBase Compound ID IjTJynk25zp
InChI InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2,4-6H,1,3,7H2
InChIKey ZMQAAUBTXCXRIC-UHFFFAOYSA-N
Mol Weight 162.19 g/mol
Molecular Formula C10H10O2
Exact Mass 162.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3H1DDKVXtUm
Name 4-ALLYL-1,2-(METHYLENEDIOXY)BENZENE
Source of Sample Fluka AG, Buchs, Switzerland
Boiling Point 233-235C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2
InChI InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2,4-6H,1,3,7H2
InChIKey ZMQAAUBTXCXRIC-UHFFFAOYSA-N
Melting Point 11.2C
Molecular Weight 162.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3
Synonyms BENZENE, 4-ALLYL-1,2-/METHYLENEDIOXY/-, SAFROLE