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(1SR,4RS,4ASR,11BRS)-4,4A,7,8-TETRAHYDRO-1H-1,4-METHANOAZEPINO-[2,1-A]-ISOINDOL-5(11BH)-ONE
SpectraBase Compound ID LJ5iJbQb5nd
InChI InChI=1S/C14H15NO/c16-14-13-10-6-5-9(8-10)12(13)11-4-2-1-3-7-15(11)14/h1-2,4-6,9-10,12-13H,3,7-8H2/t9-,10+,12+,13+/m1/s1
InChIKey YTYLRCFJYGIDBG-URBCHYCLSA-N
Mol Weight 213.28 g/mol
Molecular Formula C14H15NO
Exact Mass 213.115364 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7NyQf8fFdEf
Name (1SR,4RS,4ASR,11BRS)-4,4A,7,8-TETRAHYDRO-1H-1,4-METHANOAZEPINO-[2,1-A]-ISOINDOL-5(11BH)-ONE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H15NO
InChI InChI=1S/C14H15NO/c16-14-13-10-6-5-9(8-10)12(13)11-4-2-1-3-7-15(11)14/h1-2,4-6,9-10,12-13H,3,7-8H2/t9-,10+,12+,13+/m1/s1
InChIKey YTYLRCFJYGIDBG-URBCHYCLSA-N
Literature Reference Author A.GOMEZ-SANJUAN,N.SOTOMAYOR,E.LETE
Literature Reference Citation EUR.J.ORG.CHEM.,2013,6722(2013)
Literature Reference DOI 10.1002/ejoc.201300889
Molecular Weight 213.279 g/mol
Solvent CDCl3
Source File Reference UWBT18486