Predicted GC-MS Spectrum - GC-MS (TMS_2_6) - 70eV, Positive (FDB018499)

Spectrum Details
FooDB ID:FDB018499
Compound Name:Hv-NCC-1
Derivative IUPAC Name:Not Available
Derivative SMILES:COC(=O)C1C(=O)C2=C([NH]C(CC3=C(CCO)C(C)=C(C=O)[NH]3)=C2C)C1C1=C(CCC(=O)O[Si](C)(C)C)C(C)=C(CC2NC(=O)C(C(O)CO)=C2C)N1[Si](C)(C)C
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_6) - 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
Relative Intensity
20406080100
20406080100050100150200250300350400450500550600650700750800
050100150200250300350400450500550600650700750800
m/z
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:C35H42N4O10
Molecular Weight (Monoisotopic Mass):678.2901 Da
Derivative Type:TMS_2_6
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC(=O)C1C(=O)C2=C([NH]C(CC3=C(CCO)C(C)=C(C=O)[NH]3)=C2C)C1C1=C(CCC(=O)O[Si](C)(C)C)C(C)=C(CC2NC(=O)C(C(O)CO)=C2C)N1[Si](C)(C)C)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file754 Bytes
mzML formatted file (MZML)Download file4.67 KB
References
Not Available