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Biotin methyl ester

View entire compound with spectra: 2 NMR, and 4 MS (GC)

Biotin methyl ester
SpectraBase Compound ID 4HPTPRoBRPd
InChI InChI=1S/C11H18N2O3S/c1-16-9(14)5-3-2-4-8-10-7(6-17-8)12-11(15)13-10/h7-8,10H,2-6H2,1H3,(H2,12,13,15)
InChIKey BHEWJAXNLVWPSC-UHFFFAOYSA-N
Mol Weight 258.34 g/mol
Molecular Formula C11H18N2O3S
Exact Mass 258.103814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IY8cKYefljg
Name Biotin methyl ester
CAS Registry Number 608-16-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H18N2O3S
InChI InChI=1S/C11H18N2O3S/c1-16-9(14)5-3-2-4-8-10-7(6-17-8)12-11(15)13-10/h7-8,10H,2-6H2,1H3,(H2,12,13,15)
InChIKey BHEWJAXNLVWPSC-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference F.T. Liu, N.J. Leonhard, J. Am. Chem. Soc. 101, 996 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6