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Pancracine, O,O-dimethyl-
SpectraBase Compound ID 82QafdCgSYz
InChI InChI=1S/C18H21NO4/c1-20-15-5-12-13-8-19(14(12)6-16(15)21-2)7-10-3-17-18(4-11(10)13)23-9-22-17/h3-5,13-16H,6-9H2,1-2H3
InChIKey RCRQUNONAXMKLF-UHFFFAOYSA-N
Mol Weight 315.37 g/mol
Molecular Formula C18H21NO4
Exact Mass 315.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3sA0kHOT5v
Name Pancracine, O,O-dimethyl-
Alternate Name(s) 6,11-Methano-6H-1,3-benzodioxolo[5,6-c][1]benzazepine, pancracine deriv. Coccinine, 3-O-methyl- Manthine O,O-Dimethylpancracine
CAS Registry Number 606-51-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO4
InChI InChI=1S/C18H21NO4/c1-20-15-5-12-13-8-19(14(12)6-16(15)21-2)7-10-3-17-18(4-11(10)13)23-9-22-17/h3-5,13-16H,6-9H2,1-2H3
InChIKey RCRQUNONAXMKLF-UHFFFAOYSA-N
Molecular Weight 315.369 g/mol
SMILES COC1CC2C(=CC1OC)C1CN2Cc2cc3c(cc12)OCO3
SPLASH splash10-066r-5593000000-7819fce6a122767ab456
Source of Spectrum C-90-6442-6
Wiley ID 46999