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(TRANS-(E)-4-METHYL-2-(3-METHYLBUTA-1,3-DIENYL)-OXEPANE

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(TRANS-(E)-4-METHYL-2-(3-METHYLBUTA-1,3-DIENYL)-OXEPANE
SpectraBase Compound ID IdLnecF9ebl
InChI InChI=1S/C12H20O/c1-10(2)6-7-12-9-11(3)5-4-8-13-12/h6-7,11-12H,1,4-5,8-9H2,2-3H3/b7-6+/t11-,12+/m0/s1
InChIKey RLBHQLPVVYXAQJ-FNSAGKMKSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7mULYsYXdae
Name (TRANS-(E)-4-METHYL-2-(3-METHYLBUTA-1,3-DIENYL)-OXEPANE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-10(2)6-7-12-9-11(3)5-4-8-13-12/h6-7,11-12H,1,4-5,8-9H2,2-3H3/b7-6+/t11-,12+/m0/s1
InChIKey RLBHQLPVVYXAQJ-FNSAGKMKSA-N
Literature Reference Author S.ESCHER,Y.NICLASS
Literature Reference Citation HELV.CHIM.ACTA,74,179(1991)
Literature Reference DOI 10.1002/hlca.19910740119
Molecular Weight 180.290 g/mol
Solvent CDCl3
Source File Reference UWVP6114