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(1SR,4SR,9ASR)-1-METHYL-6-(2-METHYLPROPEN-1-YL)-4,5,7,9A-TETRAHYDRO-1,4-METHANO-2-BENZOXEPIN-3(1H)-ONE
SpectraBase Compound ID 7XSPbIT98rF
InChI InChI=1S/C16H20O2/c1-10(2)7-11-5-4-6-14-13(11)8-12-9-16(14,3)18-15(12)17/h4,6-7,12,14H,5,8-9H2,1-3H3/t12-,14-,16-/m0/s1
InChIKey JONZRHXSMXMRCV-NOLJZWGESA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2M55rpEVLDb
Name (1SR,4SR,9ASR)-1-METHYL-6-(2-METHYLPROPEN-1-YL)-4,5,7,9A-TETRAHYDRO-1,4-METHANO-2-BENZOXEPIN-3(1H)-ONE
Compound Number 43
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-10(2)7-11-5-4-6-14-13(11)8-12-9-16(14,3)18-15(12)17/h4,6-7,12,14H,5,8-9H2,1-3H3/t12-,14-,16-/m0/s1
InChIKey JONZRHXSMXMRCV-NOLJZWGESA-N
Literature Reference Author J.SAADI,I.BRUEDGAM,H.U.REISSIG
Literature Reference Citation BEIL.J.ORG.CHEM.,6,1229(2010)
Literature Reference DOI 10.3762/bjoc.6.141
Molecular Weight 244.334 g/mol
Solvent CDCl3
Source File Reference UWBT10288