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Allocryptopine

View entire compound with spectra: 4 NMR, 1 FTIR, and 6 MS (GC)

Allocryptopine
SpectraBase Compound ID 9zthlNmJfWg
InChI InChI=1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22/h4-5,9-10H,6-8,11-12H2,1-3H3
InChIKey HYBRYAPKQCZIAE-UHFFFAOYSA-N
Mol Weight 369.42 g/mol
Molecular Formula C21H23NO5
Exact Mass 369.157623 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASvn9xTSg07
Name Allocryptopine
CAS Registry Number 485-91-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H23NO5
InChI InChI=1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22/h4-5,9-10H,6-8,11-12H2,1-3H3
InChIKey HYBRYAPKQCZIAE-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference T.T. Nakashima, G.E. Maciel, Org. Magn. Resonance 5, 9 (1973).
NMR Standard Cyclohexane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3