1-(2H-1,3-benzodioxol-5-ylmethyl)-5-{[(6-chloro-2H-1,3-benzodioxol-5-yl)methane]sulfonyl}-1H-1,2,3,4-tetrazole

SpectraBase Compound ID	1JkDvS3KwtB
InChI	InChI=1S/C17H13ClN4O6S/c18-12-5-16-15(27-9-28-16)4-11(12)7-29(23,24)17-19-20-21-22(17)6-10-1-2-13-14(3-10)26-8-25-13/h1-5H,6-9H2
InChIKey	XYXKAHINKNSXFU-UHFFFAOYSA-N Google Search
Mol Weight	436.83 g/mol
Molecular Formula	C17H13ClN4O6S
Exact Mass	436.024433 g/mol

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SpectraBase Spectrum ID	1oa2Z7RjxfV
Name	1-(2H-1,3-benzodioxol-5-ylmethyl)-5-{[(6-chloro-2H-1,3-benzodioxol-5-yl)methane]sulfonyl}-1H-1,2,3,4-tetrazole
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H13ClN4O6S
InChI	InChI=1S/C17H13ClN4O6S/c18-12-5-16-15(27-9-28-16)4-11(12)7-29(23,24)17-19-20-21-22(17)6-10-1-2-13-14(3-10)26-8-25-13/h1-5H,6-9H2
InChIKey	XYXKAHINKNSXFU-UHFFFAOYSA-N
Molecular Weight	436.826 g/mol
SMILES	c1cc2OCOc2cc1C[n]1c(nnn1)S(Cc1c(cc2c(c1)OCO2)Cl)(=O)=O
SPLASH	splash10-00kr-4900000000-6090f888b4c82261f7c7
Source of Spectrum	IY-2-5059-9
Synonyms	1H-1,2,3,4-Tetrazole, 1-(1,3-benzodioxol-5-ylmethyl)-5-[[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfonyl]- 1-(1,3-benzodioxol-5-ylmethyl)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfonyl]tetrazole 1-(1,3-benzodioxol-5-ylmethyl)-5-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfonyl]-1,2,3,4-tetrazole
Wiley ID	1658582