Survey with prize
You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on Toxin, Toxin Target Database.
Spectrum Details
T3DB ID:T3D2969
Compound Name:Rifampin
Derivative IUPAC Name:Not Available
Derivative SMILES:CO[C@H]1/C=C\O[C@@]2(C)OC3=C(C)C(O)=C4C(O)=C(N=C(O)/C(C)=C\C=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)C(C=NN1CCN(C)CC1)=C(O[Si](C)(C)C)C4=C3C2=O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_1) - 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:C43H58N4O12
Molecular Weight (Monoisotopic Mass):822.4051 Da
Derivative Type:TMS_1_1
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CO[C@H]1/C=C\O[C@@]2(C)OC3=C(C)C(O)=C4C(O)=C(N=C(O)/C(C)=C\C=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)C(C=NN1CCN(C)CC1)=C(O[Si](C)(C)C)C4=C3C2=O)
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file741 Bytes
mzML formatted file (MZML)Download file4.68 KB
Not Available