Spectrum Details
CDB ID:CDB000327
Compound Name:3-[2-(4-Hydroxyphenyl)ethyl]-5-methoxyphenol
Derivative IUPAC Name:4-(2-{3-methoxy-5-[(trimethylsilyl)oxy]phenyl}ethyl)phenol
Derivative SMILES:COC1=CC(CCC2=CC=C(O)C=C2)=CC(O[Si](C)(C)C)=C1
Derivative InChIKey:InChIKey=YOCPNOKYCXYDLT-UHFFFAOYSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (1 TMS) - 70eV, Positive
Splash Key:Not Available
Notes:This is a predicted spectrum, and it should only be used as a guide. Further evidence is required to confirm identification.
Spectrum View
Experimental Conditions
Ionization Mode:Positive
Ionization Energy:70 eV
Chromatography Type:Gas Chromatography Column (GC)
Instrument Type:Single quadrupole, spectrum predicted by CFM-ID(EI)
Mass Resolution:0.0001 Da
Molecular Formula:C18H24O3Si
Molecular Weight (Monoisotopic Mass):316.149 Da
Derivative Type:1 TMS
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=CC(CCC2=CC=C(O)C=C2)=CC(O[Si](C)(C)C)=C1)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file752 Bytes
mzML formatted file (MZML)Download file4.68 KB
References
Not Available