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[(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetic acid
SpectraBase Compound ID IvqSUm8Bp2J
InChI InChI=1S/C9H6ClNO3S/c10-5-1-2-6-7(3-5)14-9(11-6)15-4-8(12)13/h1-3H,4H2,(H,12,13)
InChIKey REBJMENCTHEVCU-UHFFFAOYSA-N
Mol Weight 243.66 g/mol
Molecular Formula C9H6ClNO3S
Exact Mass 242.975692 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 87mLyX6FtnG
Name [(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C9H6ClNO3S/c10-5-1-2-6-7(3-5)14-9(11-6)15-4-8(12)13/h1-3H,4H2,(H,12,13)
InChIKey REBJMENCTHEVCU-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_4300
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/8315761; Labnumber: NP-G000162; IOH_ID: IOH-004301
Temperature 297 °C