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2XH

Summary
Name:naphthalene-1-thiol
Formula:C10 H8 S
Formal charge:0
Formula weight:160.236 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01naphthalene-1-thiol
OpenEye OEToolkits1.7.6naphthalene-1-thiol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Sc2cccc1ccccc12
InChIInChI1.03InChI=1S/C10H8S/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H
InChIKeyInChI1.03SEXOVMIIVBKGGM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Sc1cccc2ccccc12
SMILESCACTVS3.385Sc1cccc2ccccc12
SMILES_CANONICALOpenEye OEToolkits1.7.6c1ccc2c(c1)cccc2S
SMILESOpenEye OEToolkits1.7.6c1ccc2c(c1)cccc2S

222624

数据于2024-07-17公开中

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