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PHOSPHONOMETHYL-GLYCINE
SpectraBase Compound ID 1ZBihrHDToC
InChI InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)
InChIKey XDDAORKBJWWYJS-UHFFFAOYSA-N
Mol Weight 169.07 g/mol
Molecular Formula C3H8NO5P
Exact Mass 169.014009 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID BDGPrPpSh4t
Name Glyphosate_neg
CAS Registry Number 1071-83-6
Collision Gas N2
Comments FTMS - p ESI d Full ms2 [email protected] [50.00-190.00]
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Formula C3H8NO5P
InChI InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)
InChIKey XDDAORKBJWWYJS-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity N
Ionization Type HESI
Precursor Ion [M-H]-
SMILES N(CP(=O)(O)O)CC(=O)O
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge -1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD