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3-Phenyl-6,7,8,8a-tetrahydrocyclopenta[e]-s-triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID 96B9ldSqkTQ
InChI InChI=1S/C13H12N4S/c1-2-5-9(6-3-1)12-14-15-13-17(12)16-10-7-4-8-11(10)18-13/h1-3,5-6,11H,4,7-8H2
InChIKey YFLHVCIDPZRONL-UHFFFAOYSA-N
Mol Weight 256.33 g/mol
Molecular Formula C13H12N4S
Exact Mass 256.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3QlvUepexzA
Name 3-Phenyl-6,7,8,8a-tetrahydrocyclopenta[e]-s-triazolo[3,4-b][1,3,4]thiadiazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N4S
InChI InChI=1S/C13H12N4S/c1-2-5-9(6-3-1)12-14-15-13-17(12)16-10-7-4-8-11(10)18-13/h1-3,5-6,11H,4,7-8H2
InChIKey YFLHVCIDPZRONL-UHFFFAOYSA-N
Molecular Weight 256.327 g/mol
SMILES c12[n](c(nn2)-c2ccccc2)N=C2C(S1)CCC2
SPLASH splash10-0a4i-6690000000-5c5588a210ebe415a0b6
Source of Spectrum F4-42-2639-7a
Wiley ID 1673930