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thiobenzoate

PropertiesImage
MNX_IDMNXM113515 Image of MNXM113515
referencemetacycM:CPD-14746
formulaC7H6OS
global charge0
mol weight138.191
InChIKeyUIJGNTRUPZPVNG-UHFFFAOYSA-N
InChIInChI=1S/C7H6OS/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
SMILESO=C(S)C1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C7H6OS/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9) Image of MNXM113515
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:6]([C:7](=[O:8])[SH:9])[CH:5]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-14746
metacycM:CPD-14746
UIJGNTRUPZPVNG-UHFFFAOYSA-N
thiobenzoate
benzenecarbothioc acid
benzoyl thiol
monothiolbenzoic acid
thiobenzoic acid
thiolbenzoic acid

seed.compound:cpd32074
seedM:cpd32074
UIJGNTRUPZPVNG-UHFFFAOYSA-M
benzenecarbothioc acid
benzoyl thiol
monothiolbenzoic acid
thiobenzoate
thiobenzoic acid
thiolbenzoic acid

seedM:M_cpd32074
secondary/obsolete/fantasy identifier