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4-(Benzooxazol-2-ylsulfanylmethyl)-benzoic acid

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4-(Benzooxazol-2-ylsulfanylmethyl)-benzoic acid
SpectraBase Compound ID FEsPPIKgQVY
InChI InChI=1S/C15H11NO3S/c17-14(18)11-7-5-10(6-8-11)9-20-15-16-12-3-1-2-4-13(12)19-15/h1-8H,9H2,(H,17,18)
InChIKey XCKAGLDDLJTRBV-UHFFFAOYSA-N
Mol Weight 285.32 g/mol
Molecular Formula C15H11NO3S
Exact Mass 285.045964 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 96AeNVwpdr
Name benzoic acid, 4-[(2-benzoxazolylthio)methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 285.045964389 u
Formula C15H11NO3S
InChI InChI=1S/C15H11NO3S/c17-14(18)11-7-5-10(6-8-11)9-20-15-16-12-3-1-2-4-13(12)19-15/h1-8H,9H2,(H,17,18)
InChIKey XCKAGLDDLJTRBV-UHFFFAOYSA-N
Molecular Weight 285.317 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8974
Solvent DMSO-d6
Source Vendor ID: NMR/9223361; Lab Info: LP; Lab Number: LP-2190393