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Benzo[7,8]cycloocta[1,2-d][1,2,3]thiadiazole, 4,5,6,7-tetrahydro-
SpectraBase Compound ID IAj6KApiuhB
InChI InChI=1S/C12H12N2S/c1-3-7-10-9(5-1)6-2-4-8-11-12(10)13-14-15-11/h1,3,5,7H,2,4,6,8H2
InChIKey INEOAAXQWYVTCF-UHFFFAOYSA-N
Mol Weight 216.3 g/mol
Molecular Formula C12H12N2S
Exact Mass 216.07212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rpEIfbzq0g
Name Benzo[7,8]cycloocta[1,2-d][1,2,3]thiadiazole, 4,5,6,7-tetrahydro-
CAS Registry Number 73424-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2S
InChI InChI=1S/C12H12N2S/c1-3-7-10-9(5-1)6-2-4-8-11-12(10)13-14-15-11/h1,3,5,7H,2,4,6,8H2
InChIKey INEOAAXQWYVTCF-UHFFFAOYSA-N
Molecular Weight 216.302 g/mol
SMILES c-12nnsc2CCCCc2c1cccc2
SPLASH splash10-0a4r-0900000000-57669b14581aa16e1609
Source of Spectrum K-113-190-0
Synonyms 4,5,6,7-Tetrahydrobenzo[3,4]cycloocta[2,1-d][1,2,3]thiadiazole 4,5,6,7-tetrahydrobenzo[7,8]cycloocta[1,2-d][1,2,3]thiadiazole
Wiley ID 1215548