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(3R,6R,7E,9E,11E)-3-HYDROXY-13-APO-ALPHA-CAROTEN-13-ONE
SpectraBase Compound ID A8qzzUbsMfq
InChI InChI=1S/C18H26O2/c1-13(7-6-8-15(3)19)9-10-17-14(2)11-16(20)12-18(17,4)5/h6-11,16-17,20H,12H2,1-5H3/b8-6+,10-9+,13-7+/t16-,17-/m1/s1
InChIKey VFISUJDCZMSIKT-YBFUNYAWSA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bt7MOIWVy7N
Name (3R,6R,7E,9E,11E)-3-HYDROXY-13-APO-ALPHA-CAROTEN-13-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-13(7-6-8-15(3)19)9-10-17-14(2)11-16(20)12-18(17,4)5/h6-11,16-17,20H,12H2,1-5H3/b8-6+,10-9+,13-7+/t16-,17-/m1/s1
InChIKey VFISUJDCZMSIKT-YBFUNYAWSA-N
Literature Reference Author M.DELLAGRECA,C.D.MARINO,A.ZARRELLI,B.DABROSCA
Literature Reference Citation J.NAT.PROD.,67,1492(2004)
Literature Reference DOI 10.1021/np049857q
Molecular Weight 274.403 g/mol
Solvent CDCl3
Source File Reference UWMZ8049