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YBJHBAHKTGYVGT-UHFFFAOYSA-N

View entire compound with spectra: 6 NMR, and 7 MS (GC)

YBJHBAHKTGYVGT-UHFFFAOYSA-N
SpectraBase Compound ID 3DNVQsbU2Mv
InChI InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)
InChIKey YBJHBAHKTGYVGT-UHFFFAOYSA-N
Mol Weight 244.31 g/mol
Molecular Formula C10H16N2O3S
Exact Mass 244.088164 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID zXUX8Uih8i
Name D-Biotin
CAS Registry Number 58-85-5
Comments PH=7.9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H16N2O3S
InChI InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)
InChIKey YBJHBAHKTGYVGT-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference M. Ikura, K. Hikichi, Org. Magn. Resonance 20, 266 (1982).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O