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Lovastatin MS3_1
SpectraBase Compound ID 5mpVGShtRU0
InChI InChI=1S/C14H12N3O2/c1-16-14(10-5-3-2-4-6-10)12-9-11(17(18)19)7-8-13(12)15/h2-9,15H,1H3/q+1/b15-13?,16-14-
InChIKey LLRMJRPCOGEJEN-HXQOECQISA-N
Mol Weight 254.27 g/mol
Molecular Formula C14H12N3O2
Exact Mass 254.092952 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7FICvk9hyf9
Name Lovastatin MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [65.00-300.00]
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InChI InChI=1S/C14H12N3O2/c1-16-14(10-5-3-2-4-6-10)12-9-11(17(18)19)7-8-13(12)15/h2-9,15H,1H3/q+1/b15-13?,16-14-
InChIKey LLRMJRPCOGEJEN-HXQOECQISA-N
Ion Polarity P
Ionization Type ESI
SMILES N=C1C=C[C+](C=C1\C(=N/C)C=1C=CC=CC1)N(=O)=O
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS