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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
Mol Weight 370.81 g/mol
Molecular Formula C17H11ClN4O2S
Exact Mass 370.029124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dSAgtkn775
Name 2-(6-Chloro-benzo[1,3]dioxol-5-ylmethylsulfanyl)-9H-1,3,4,9-tetraaza-fluorene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
SMILES [nH]1c2ccccc2c2c1nc(nn2)SCc1c(cc2c(c1)OCO2)Cl
SPLASH splash10-000i-1908000000-c4c8b170084a8032e120
Synonyms 3-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-5H-[1,2,4]triazino[5,6-b]indole 3-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-5H-[1,2,4]triazino[5,6-b]indole 3-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-5H-[1,2,4]triazino[5,6-b]indole 3-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-5H-[1,2,4]triazin[5,6-b]indole
Wiley ID 1462740