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5-(3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylsulfanyl)pentanoic acid
SpectraBase Compound ID 7xYOOJxHPXj
InChI InChI=1S/C9H11N5O2S/c15-6(16)3-1-2-4-17-9-7-8(10-5-11-9)13-14-12-7/h5H,1-4H2,(H,15,16)(H,10,11,12,13,14)
InChIKey FAQVPLXZJNYGCN-UHFFFAOYSA-N
Mol Weight 253.28 g/mol
Molecular Formula C9H11N5O2S
Exact Mass 253.063346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5PB8d7UMTXZ
Name 5-(3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylsulfanyl)pentanoic 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/C9H11N5O2S/c15-6(16)3-1-2-4-17-9-7-8(10-5-11-9)13-14-12-7/h5H,1-4H2,(H,15,16)(H,10,11,12,13,14)
InChIKey FAQVPLXZJNYGCN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16724
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: 987/00004293; Labnumber: 987/00004293218852; VK_ID: VK-016729
Temperature 318 °C