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Boldine
SpectraBase Compound ID 24LFAqUd34M
InChI InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3
InChIKey LZJRNLRASBVRRX-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 Q6XNOohnc
Name Boldine @
CAS Registry Number 476-70-0
Classification Alkaloid
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Exact Mass 327.147058156 u
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3
InChIKey LZJRNLRASBVRRX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 327.380 g/mol
SMILES c1(O)cc2CCN(C3c2c(c1OC)-c1c(C3)cc(c(c1)OC)O)C
SPLASH splash10-004i-2779000000-13fa0b4b223978a7c5cf
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 Glaucine-M (bis-O-demethyl-)
Technique GC/MS
Wiley ID MMPW6e_8104