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CRAMBESCIN-A

View entire compound with spectra: 1 NMR

CRAMBESCIN-A
SpectraBase Compound ID AFogOmuBKLc
InChI InChI=1S/C22H40N6O2/c1-2-3-4-5-6-7-8-12-17-19(18-13-11-15-28(18)22(25)27-17)20(29)30-16-10-9-14-26-21(23)24/h17H,2-16H2,1H3,(H2,25,27)(H4,23,24,26)
InChIKey CNYOJFKISRGTCX-UHFFFAOYSA-N
Mol Weight 420.6 g/mol
Molecular Formula C22H40N6O2
Exact Mass 420.321275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ETkMiffXjKt
Name CRAMBESCIN-A
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H40N6O2
InChI InChI=1S/C22H40N6O2/c1-2-3-4-5-6-7-8-12-17-19(18-13-11-15-28(18)22(25)27-17)20(29)30-16-10-9-14-26-21(23)24/h17H,2-16H2,1H3,(H2,25,27)(H4,23,24,26)
InChIKey CNYOJFKISRGTCX-UHFFFAOYSA-N
Literature Reference Author A.D.PATIL,N.V.KUMAR,W.C.KOKKE,M.F.BEAN,A.J.FREYER,C.DEBROSSE ,S.MAI,A.TRUNEH,D.J.
Literature Reference Citation J.ORG.CHEM.,60,1182(1995)
Literature Reference DOI 10.1021/jo00110a021
Molecular Weight 420.599 g/mol
Solvent METHANOL-D4
Source File Reference UWGE500