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2-Amino-6-(thymine-N(1)-yl)-hexanoic acid

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2-Amino-6-(thymine-N(1)-yl)-hexanoic acid
SpectraBase Compound ID HYQe0W5SxWt
InChI InChI=1S/C11H17N3O4/c1-7-6-14(11(18)13-9(7)15)5-3-2-4-8(12)10(16)17/h6,8H,2-5,12H2,1H3,(H,16,17)(H,13,15,18)
InChIKey SWTDKCIDPQYUCZ-UHFFFAOYSA-N
Mol Weight 255.27 g/mol
Molecular Formula C11H17N3O4
Exact Mass 255.121906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7r3llccqwv1
Name 2-Amino-6-(thymine-N(1)-yl)-hexanoic acid
CAS Registry Number 76945-38-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H17N3O4
InChI InChI=1S/C11H17N3O4/c1-7-6-14(11(18)13-9(7)15)5-3-2-4-8(12)10(16)17/h6,8H,2-5,12H2,1H3,(H,16,17)(H,13,15,18)
InChIKey SWTDKCIDPQYUCZ-UHFFFAOYSA-N
Literature Reference I. Saito, H. Sugiyama, S.Ito, J. Am. Chem. Soc. 103, 1598 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported