2-(6-Chloro-benzo[1,3]dioxol-5-ylmethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene

SpectraBase Compound ID	KkBqrUyVN1t
InChI	InChI=1S/C17H11ClN4O2S/c18-11-6-14-13(23-8-24-14)5-9(11)7-25-17-20-16-15(21-22-17)10-3-1-2-4-12(10)19-16/h1-6H,7-8H2,(H,19,20,22)
InChIKey	WWCMTHLNRUTLQV-UHFFFAOYSA-N Google Search
Mol Weight	370.81 g/mol
Molecular Formula	C17H11ClN4O2S
Exact Mass	370.029124 g/mol

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SpectraBase Spectrum ID	30GxkYlerM8
Name	5H-[1,2,4]triazino[5,6-b]indole, 3-[[(6-chloro-1,3-benzodioxol-5-yl)methyl]thio]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	370.029124482 u
Formula	C17H11ClN4O2S
InChI	InChI=1S/C17H11ClN4O2S/c18-11-6-14-13(23-8-24-14)5-9(11)7-25-17-20-16-15(21-22-17)10-3-1-2-4-12(10)19-16/h1-6H,7-8H2,(H,19,20,22)
InChIKey	WWCMTHLNRUTLQV-UHFFFAOYSA-N
Molecular Weight	370.814 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_14780
Solvent	DMSO-d6
Source	Vendor ID: NMR/10310757; Lab Info: SAD; Lab Number: 97