N-(tert-butoxycarbonyl)-3-[(3-nitro-2-pyridinyl)disulfanyl]alanine

SpectraBase Compound ID	CcsLgMzlqdV
InChI	InChI=1S/C13H17N3O6S2/c1-13(2,3)22-12(19)15-8(11(17)18)7-23-24-10-9(16(20)21)5-4-6-14-10/h4-6,8H,7H2,1-3H3,(H,15,19)(H,17,18)
InChIKey	OVTLOLNDKQUMRH-UHFFFAOYSA-N Google Search
Mol Weight	375.41 g/mol
Molecular Formula	C13H17N3O6S2
Exact Mass	375.055878 g/mol

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SpectraBase Spectrum ID	4UBXR4SLHp4
Name	N-(tert-butoxycarbonyl)-3-[(3-nitro-2-pyridinyl)disulfanyl]alanine
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/C13H17N3O6S2/c1-13(2,3)22-12(19)15-8(11(17)18)7-23-24-10-9(16(20)21)5-4-6-14-10/h4-6,8H,7H2,1-3H3,(H,15,19)(H,17,18)
InChIKey	OVTLOLNDKQUMRH-UHFFFAOYSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_ASIOH_7000_826
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: ZID/5049479; Labnumber: DGP-174; IOH_ID: IOH-000827
Temperature	303 °C