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SAPHENIC-ACID-METHYLESTER
SpectraBase Compound ID I8dLjENV3rr
InChI InChI=1S/C16H16N2O3/c1-9(19)10-5-3-7-12-14(10)17-13-8-4-6-11(15(13)18-12)16(20)21-2/h3-9,17-19H,1-2H3
InChIKey KQDMVBHMXPBXSD-UHFFFAOYSA-N
Mol Weight 284.31 g/mol
Molecular Formula C16H16N2O3
Exact Mass 284.116092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CU4MQedy0XA
Name SAPHENIC-ACID-METHYLESTER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16N2O3
InChI InChI=1S/C16H16N2O3/c1-9(19)10-5-3-7-12-14(10)17-13-8-4-6-11(15(13)18-12)16(20)21-2/h3-9,17-19H,1-2H3
InChIKey KQDMVBHMXPBXSD-UHFFFAOYSA-N
Literature Reference Author C.W.VANTLAND,U.MOCEK,H.G.FLOSS
Literature Reference Citation J.ORG.CHEM.,58,6576(1993)
Literature Reference DOI 10.1021/jo00076a014
Molecular Weight 284.315 g/mol
Solvent CDCl3
Source File Reference UWGE2317