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MKYLOMHWHWEFCT-UHFFFAOYSA-N
SpectraBase Compound ID Av9iiwdvHLJ
InChI InChI=1S/C17H19NO4/c1-20-15-4-11-12-7-18(13(11)5-14(15)19)6-9-2-16-17(3-10(9)12)22-8-21-16/h2-4,12-15,19H,5-8H2,1H3
InChIKey MKYLOMHWHWEFCT-UHFFFAOYSA-N
Mol Weight 301.34 g/mol
Molecular Formula C17H19NO4
Exact Mass 301.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1xjzvr925Q
Name Pancracine, O2-methyl-, (2.beta.)-
CAS Registry Number 485-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO4
InChI InChI=1S/C17H19NO4/c1-20-15-4-11-12-7-18(13(11)5-14(15)19)6-9-2-16-17(3-10(9)12)22-8-21-16/h2-4,12-15,19H,5-8H2,1H3
InChIKey MKYLOMHWHWEFCT-UHFFFAOYSA-N
Molecular Weight 301.342 g/mol
SMILES OC1CC2C(=CC1OC)C1CN2Cc2cc3c(cc12)OCO3
SPLASH splash10-0uk9-4695000000-44416fcdde9fd88cc3c0
Source of Spectrum CD-107-0-0
Synonyms 6,11-Methano-6H-1,3-benzodioxolo[5,6-c][1]benzazepine, pancracine deriv. Coccinine Coccinine (alkaloid) Pancracine, O2-methyl- Montanine Montanine (C17 alkaloid) Montanine (Haemanthus) O2-Methyl-2-epipancracine
Wiley ID 1303831