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Benzocaine MS3_1
SpectraBase Compound ID Ls4wBaZ5kmj
InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)/p+1
InChIKey ALYNCZNDIQEVRV-UHFFFAOYSA-O
Mol Weight 138.15 g/mol
Molecular Formula C7H8NO2
Exact Mass 138.055503 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 1IvdvyEwkN
Name Benzocaine MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected]
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InChI InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)/p+1
InChIKey ALYNCZNDIQEVRV-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [OH2+]C(C1=CC=C(C=C1)N)=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