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Metachromin A

View entire compound with spectra: 2 NMR, and 2 MS (GC)

Metachromin A
SpectraBase Compound ID 3sLWVCbCowE
InChI InChI=1S/C22H30O4/c1-14(10-12-22(4)11-6-7-15(2)16(22)3)8-9-17-20(24)18(23)13-19(26-5)21(17)25/h8,13,15,24H,3,6-7,9-12H2,1-2,4-5H3/b14-8+/t15-,22-/m1/s1
InChIKey IAMSURZACLERPY-XMRYUXBUSA-N
Mol Weight 358.48 g/mol
Molecular Formula C22H30O4
Exact Mass 358.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ej36HpgFSjn
Name METACHROMINE-A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O4
InChI InChI=1S/C22H30O4/c1-14(10-12-22(4)11-6-7-15(2)16(22)3)8-9-17-20(24)18(23)13-19(26-5)21(17)25/h8,13,15,24H,3,6-7,9-12H2,1-2,4-5H3/b14-8+/t15-,22-/m1/s1
InChIKey IAMSURZACLERPY-XMRYUXBUSA-N
Literature Reference Author J.KOBAYASHI,K.NAITOH,T.SASAKI,H.SHIGEMORI
Literature Reference Citation J.ORG.CHEM.,57,5773(1992)
Literature Reference DOI 10.1021/jo00047a039
Molecular Weight 358.478 g/mol
Solvent CDCl3
Source File Reference UWCS3990