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N-Acetyl-Coclaurine
SpectraBase Compound ID vEdfYMO4Za
InChI InChI=1S/C19H21NO4/c1-12(21)20-8-7-14-10-19(24-2)18(23)11-16(14)17(20)9-13-3-5-15(22)6-4-13/h3-6,10-11,17,22-23H,7-9H2,1-2H3
InChIKey KLWLYPULZNBFPT-UHFFFAOYSA-N
Mol Weight 327.38 g/mol
Molecular Formula C19H21NO4
Exact Mass 327.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SbxXSHH0E1
Name N-Acetyl-Coclaurine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-12(21)20-8-7-14-10-19(24-2)18(23)11-16(14)17(20)9-13-3-5-15(22)6-4-13/h3-6,10-11,17,22-23H,7-9H2,1-2H3
InChIKey KLWLYPULZNBFPT-UHFFFAOYSA-N
Molecular Weight 327.380 g/mol
SMILES Oc1c(cc2CCN(C(Cc3ccc(cc3)O)c2c1)C(=O)C)OC
SPLASH splash10-0200-0930000000-063a27b15fce099664f7
Source of Spectrum X2-53-558-5
Wiley ID 1603519