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(-)-TETRAHYDROPALMITINE
SpectraBase Compound ID LG0WScfAZjc
InChI InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3/t17-/m0/s1
InChIKey AEQDJSLRWYMAQI-KRWDZBQOSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLsTF6pDe3j
Name Tetrahydropalmatine
Classification Pharmaceutical drug, analgesic, non-narcotic
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 355.178358285 u
Formula C21H25NO4
InChI InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3/t17-/m0/s1
InChIKey AEQDJSLRWYMAQI-KRWDZBQOSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 355.434 g/mol
Nominal Mass 355 u
Quality 905
Retention Index 2790
SMILES [C@@]12(C=3C(=CC(=C(C3)OC)OC)CCN1CC=1C(C2)=CC=C(C1OC)OC)[H]
SPLASH splash10-11ba-1915000000-363bab3df25473afe832
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Caseanine Gindarine (13aS)-2,3,9,10-Tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Technique GC/MS
Wiley ID DD2024_012157