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Nateglinide MS3_1
SpectraBase Compound ID KRBwFh2eHCx
InChI InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/p+1
InChIKey COLNVLDHVKWLRT-UHFFFAOYSA-O
Mol Weight 166.2 g/mol
Molecular Formula C9H12NO2
Exact Mass 166.086804 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 2UVPr42eCrg
Name Nateglinide MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-180.00]
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InChI InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/p+1
InChIKey COLNVLDHVKWLRT-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [NH3+]C(C(=O)O)CC1=CC=CC=C1
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