Spectrum Details
CDB ID:CDB000462
Compound Name:Borneol
Derivative IUPAC Name:trimethyl({[(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl]oxy})silane
Derivative SMILES:CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](O[Si](C)(C)C)C2
Derivative InChIKey:InChIKey=RUVRGUBFCPLVCZ-MDZLAQPJSA-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:C13H26OSi
Molecular Weight (Monoisotopic Mass):226.175 Da
Derivative Type:1 TMS
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](O[Si](C)(C)C)C2)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file741 Bytes
mzML formatted file (MZML)Download file4.68 KB
References
Not Available