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2-ACETYLAMINO-3-HYDROXY-4-METHYL-OCT-6-ENOIC-ACID-METHYLESTER
SpectraBase Compound ID IZyGO6WyJIk
InChI InChI=1S/C12H21NO4/c1-5-6-7-8(2)11(15)10(12(16)17-4)13-9(3)14/h5-6,8,10-11,15H,7H2,1-4H3,(H,13,14)/b6-5+/t8-,10+,11-/m1/s1
InChIKey SMQHAZZJZSRRRB-CUCIBPGNSA-N
Mol Weight 243.3 g/mol
Molecular Formula C12H21NO4
Exact Mass 243.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4gxyTTS6OQy
Name 2-ACETYLAMINO-3-HYDROXY-4-METHYL-OCT-6-ENOIC-ACID-METHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H21NO4
InChI InChI=1S/C12H21NO4/c1-5-6-7-8(2)11(15)10(12(16)17-4)13-9(3)14/h5-6,8,10-11,15H,7H2,1-4H3,(H,13,14)/b6-5+/t8-,10+,11-/m1/s1
InChIKey SMQHAZZJZSRRRB-CUCIBPGNSA-N
Literature Reference Author H.NAKAJIMA,T.HAMASAKI,K.NISHIMURA,T.KONDO,Y.KIMURA,S.I.UDAGA WA,S.SATO
Literature Reference Citation AGR.BIOL.CHEM.,52,1621(1988)
Literature Reference DOI 10.1271/bbb1961.52.1621
Molecular Weight 243.303 g/mol
Solvent ACETONE-D6
Source File Reference UWIR7944