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Dopamine 3AC
SpectraBase Compound ID LXu7XBQVAIS
InChI InChI=1S/C14H17NO5/c1-9(16)15-7-6-12-4-5-13(19-10(2)17)14(8-12)20-11(3)18/h4-5,8H,6-7H2,1-3H3,(H,15,16)
InChIKey HABRVLDLGFSKNH-UHFFFAOYSA-N
Mol Weight 279.29 g/mol
Molecular Formula C14H17NO5
Exact Mass 279.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hNrRWv01BQ
Name Dopamine 3AC @
Classification Biomolecule Sympathomimetic
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Exact Mass 279.110672646 u
Formula C14H17NO5
InChI InChI=1S/C14H17NO5/c1-9(16)15-7-6-12-4-5-13(19-10(2)17)14(8-12)20-11(3)18/h4-5,8H,6-7H2,1-3H3,(H,15,16)
InChIKey HABRVLDLGFSKNH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 279.292 g/mol
Related CAS Registry Number(s) 51-61-6
SMILES c1(c(OC(=O)C)ccc(c1)CCNC(=O)C)OC(=O)C
SPLASH splash10-000i-0920000000-cdc0d568efbf683c7c52
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.
Sample Preparation Procedure Detected: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms 3,4-Dihydroxyphenethylamine 3AC 3-Hydroxytyramine 3AC
Technique GC/MS
Wiley ID MMPW6e_5284