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Methyldopa ME4AC
SpectraBase Compound ID Gs01CbYZFgQ
InChI InChI=1S/C19H23NO8/c1-11(21)20(12(2)22)19(5,18(25)26-6)10-15-7-8-16(27-13(3)23)17(9-15)28-14(4)24/h7-9H,10H2,1-6H3
InChIKey RLVZZUHJPGNBOH-UHFFFAOYSA-N
Mol Weight 393.39 g/mol
Molecular Formula C19H23NO8
Exact Mass 393.142367 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6K0TqmzaTWj
Name Methyldopa ME4AC
Classification Antihypertensive
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Exact Mass 393.142366697 u
Formula C19H23NO8
InChI InChI=1S/C19H23NO8/c1-11(21)20(12(2)22)19(5,18(25)26-6)10-15-7-8-16(27-13(3)23)17(9-15)28-14(4)24/h7-9H,10H2,1-6H3
InChIKey RLVZZUHJPGNBOH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 393.392 g/mol
Related CAS Registry Number(s) 555-30-6
SMILES C(N(C(=O)C)C(=O)C)(C(=O)OC)(Cc1cc(OC(=O)C)c(cc1)OC(=O)C)C
SPLASH splash10-00rf-2910000000-1afaf44a96ec630fdb0f
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_5121