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Caseamine
SpectraBase Compound ID 8XCbks4TIhI
InChI InChI=1S/C19H21NO4/c1-23-16-4-3-11-5-6-20-10-13-8-15(21)17(24-2)9-12(13)7-14(20)18(11)19(16)22/h3-4,8-9,14,21-22H,5-7,10H2,1-2H3
InChIKey IVAIKLPWWORRPT-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 D2RxWVOAv8u
Name Caseamine
CAS Registry Number 27498-04-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-23-16-4-3-11-5-6-20-10-13-8-15(21)17(24-2)9-12(13)7-14(20)18(11)19(16)22/h3-4,8-9,14,21-22H,5-7,10H2,1-2H3
InChIKey IVAIKLPWWORRPT-UHFFFAOYSA-N
Molecular Weight 327.380 g/mol
SMILES Oc1cc2CN3C(c4c(c(ccc4CC3)OC)O)Cc2cc1OC
SPLASH splash10-0fb9-0901000000-9fe67e3c4598c439206c
Source of Spectrum CD-121-0-0
Synonyms 2,11-dimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-1,10-diol
Wiley ID 1325597