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2-{[(5E)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]amino}benzonitrile
SpectraBase Compound ID LxMSNjTg0Va
InChI InChI=1S/C9H4ClN3S2/c10-8-9(14-15-13-8)12-7-4-2-1-3-6(7)5-11/h1-4H/b12-9+
InChIKey DLEGQQHRXZEGOQ-FMIVXFBMSA-N
Mol Weight 253.72 g/mol
Molecular Formula C9H4ClN3S2
Exact Mass 252.953517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FMUagOJKCZY
Name 2-{[(5E)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]amino}benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4ClN3S2
InChI InChI=1S/C9H4ClN3S2/c10-8-9(14-15-13-8)12-7-4-2-1-3-6(7)5-11/h1-4H/b12-9+
InChIKey DLEGQQHRXZEGOQ-FMIVXFBMSA-N
Molecular Weight 253.725 g/mol
SMILES C=1(\C(SSN1)=N/c1c(C#N)cccc1)Cl
SPLASH splash10-0w2c-7950000000-2a446d69b2fd5199bf71
Source of Spectrum F4-41-4169-1a
Synonyms 2-(4-Chloro-5H-1,2,3-dithiazol-5-ylideneamino)benzonitrile
Wiley ID 1673261