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3A,5,5-TRIMETHYL-1-PHENYL-3A,4,5,6-TETRAHYDRO-[1,2,4]-OXADIAZOLO-[5,4-D]-[1,5]-BENZODIAZEPINE
SpectraBase Compound ID H137nXi06Zx
InChI InChI=1S/C19H21N3O/c1-18(2)13-19(3)22(16-12-8-7-11-15(16)20-18)17(21-23-19)14-9-5-4-6-10-14/h4-12,20H,13H2,1-3H3/t19-/m0/s1
InChIKey JKRZHBNLPINNHO-IBGZPJMESA-N
Mol Weight 307.4 g/mol
Molecular Formula C19H21N3O
Exact Mass 307.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9rdYEdyf2Ae
Name 3A,5,5-TRIMETHYL-1-PHENYL-3A,4,5,6-TETRAHYDRO-[1,2,4]-OXADIAZOLO-[5,4-D]-[1,5]-BENZODIAZEPINE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21N3O
InChI InChI=1S/C19H21N3O/c1-18(2)13-19(3)22(16-12-8-7-11-15(16)20-18)17(21-23-19)14-9-5-4-6-10-14/h4-12,20H,13H2,1-3H3/t19-/m0/s1
InChIKey JKRZHBNLPINNHO-IBGZPJMESA-N
Literature Reference Author A.CHIMIRRI,S.GRASSO,R.OTTANA,G.ROMEO,M.ZAPPALA
Literature Reference Citation J.HETCYCL.CHEM.,27,371(1990)
Literature Reference DOI 10.1002/jhet.5570270250
Molecular Weight 307.395 g/mol
Solvent CDCl3
Source File Reference UWCP3423