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2,4-Cyclohexadien-1-one, 6-(4-chloro-5H-1,2,3-dithiazol-5-yliden)-4-methoxy-
SpectraBase Compound ID 53aVEnjnRS6
InChI InChI=1S/C9H6ClNO2S2/c1-13-5-2-3-7(12)6(4-5)8-9(10)11-15-14-8/h2-4H,1H3/b8-6-
InChIKey OXNXRRYIRPHTIS-VURMDHGXSA-N
Mol Weight 259.72 g/mol
Molecular Formula C9H6ClNO2S2
Exact Mass 258.952848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRRMdtZEQrB
Name 2,4-Cyclohexadien-1-one, 6-(4-chloro-5H-1,2,3-dithiazol-5-yliden)-4-methoxy-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6ClNO2S2
InChI InChI=1S/C9H6ClNO2S2/c1-13-5-2-3-7(12)6(4-5)8-9(10)11-15-14-8/h2-4H,1H3/b8-6-
InChIKey OXNXRRYIRPHTIS-VURMDHGXSA-N
Molecular Weight 259.725 g/mol
SMILES C=1\C(=C/2C(=NSS2)Cl)C(C=CC1OC)=O
SPLASH splash10-00xr-9570000000-d59fda68fbf27d29da02
Source of Spectrum IY-1-4407-1
Synonyms (6Z)-6-(4-chloro-5-dithiazolylidene)-4-methoxy-1-cyclohexa-2,4-dienone (6Z)-6-(4-chlorodithiazol-5-ylidene)-4-methoxycyclohexa-2,4-dien-1-one (6Z)-6-(4-chloranyl-1,2,3-dithiazol-5-ylidene)-4-methoxy-cyclohexa-2,4-dien-1-one
Wiley ID 1652054