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1-decanesulfonate

PropertiesImage
MNX_IDMNXM155110 Image of MNXM155110
referencemetacycM:CPD0-2546
formulaC10H21O3S
global charge-1
mol weight221.342
InChIKeyKVGOXGQSTGQXDD-UHFFFAOYSA-M
InChIInChI=1S/C10H22O3S/c1-2-3-4-5-6-7-8-9-10-14(11,12)13/h2-10H2,1H3,(H,11,12,13)/p-1
SMILESCCCCCCCCCCS(=O)(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C10H22O3S/c1-2-3-4-5-6-7-8-9-10-14(11,12)13/h2-10H2,1H3,(H,11,12,13) Image of MNXM155110
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][S:14]([OH:11])(=[O:12])=[O:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD0-2546
metacycM:CPD0-2546
seed.compound:cpd33589
seedM:cpd33589
KVGOXGQSTGQXDD-UHFFFAOYSA-M
1-decanesulfonate
decane-1-sulfonate
hmdb:HMDB0250916
KVGOXGQSTGQXDD-UHFFFAOYSA-N
Decane-1-sulfonic acid
1-DECANE-sulphonic-acid
1-decane-sulfonic-acid
DECANE-1-sulfonate
DECANE-1-sulphonate
DECANE-1-sulphonic acid
decane-1-sulfonic acid

seedM:M_cpd33589
secondary/obsolete/fantasy identifier