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[3-(1H-1,2,4-triazol-1-yl)-1-adamantyl]acetic acid

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[3-(1H-1,2,4-triazol-1-yl)-1-adamantyl]acetic acid
SpectraBase Compound ID 4GZgRafLQyf
InChI InChI=1S/C14H19N3O2/c18-12(19)6-13-2-10-1-11(3-13)5-14(4-10,7-13)17-9-15-8-16-17/h8-11H,1-7H2,(H,18,19)
InChIKey CMIJPLZEWJHJBD-UHFFFAOYSA-N
Mol Weight 261.32 g/mol
Molecular Formula C14H19N3O2
Exact Mass 261.147727 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 627FTEHUHmx
Name [3-(1H-1,2,4-triazol-1-yl)-1-adamantyl]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/C14H19N3O2/c18-12(19)6-13-2-10-1-11(3-13)5-14(4-10,7-13)17-9-15-8-16-17/h8-11H,1-7H2,(H,18,19)
InChIKey CMIJPLZEWJHJBD-UHFFFAOYSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14735
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: UZI/1020081; UBI_ID: UBI-014738
Temperature 300 °C