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Noradrenaline 4AC
SpectraBase Compound ID 2NzDMn6Mrd3
InChI InChI=1S/C16H19NO7/c1-9(18)17-8-16(24-12(4)21)13-5-6-14(22-10(2)19)15(7-13)23-11(3)20/h5-7,16H,8H2,1-4H3,(H,17,18)/t16-/m0/s1
InChIKey KWZHCLSAXAIWJN-INIZCTEOSA-N
Mol Weight 337.33 g/mol
Molecular Formula C16H19NO7
Exact Mass 337.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FnkKIewSPI
Name Noradrenaline 4AC
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 337.116151949 u
Formula C16H19NO7
InChI InChI=1S/C16H19NO7/c1-9(18)17-8-16(24-12(4)21)13-5-6-14(22-10(2)19)15(7-13)23-11(3)20/h5-7,16H,8H2,1-4H3,(H,17,18)/t16-/m0/s1
InChIKey KWZHCLSAXAIWJN-INIZCTEOSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 337.328 g/mol
Nominal Mass 337 u
Quality 940
Retention Index 2509
SMILES C1([C@](CNC(=O)C)(OC(=O)C)[H])=CC(=C(C=C1)OC(=O)C)OC(=O)C
SPLASH splash10-0006-9320000000-a5e7a48260d03a299729
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(acetyloxy)-4-((1R)-2-(diacetylamino)-1-hydroxyethyl)phenyl acetate
Technique GC/MS
Wiley ID DD2024_003274