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7-methyl-3-oxaspiro[3.5]nona-6,8-diene-1-sulfonic acid

7-methyl-3-oxaspiro[3.5]nona-6,8-diene-1-sulfonic acid

Systemtic Name:7-methyl-3-oxaspiro[3.5]nona-6,8-diene-1-sulfonic acid
Openeye Name:7-methyl-3-oxaspiro[3.5]nona-6,8-diene-1-sulfonic acid
CAS Name:7-methyl-3-oxaspiro[3.5]nona-6,8-diene-1-sulfonic acid
IUPAC Name:7-methyl-3-oxaspiro[3.5]nona-6,8-diene-1-sulfonic acid
Traditional Name:7-methyl-3-oxaspiro[3.5]nona-6,8-diene-1-sulfonic acid
Formula: C9H12O4S
MolecularWeight: 216.25418
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2(C=C1)C(CO2)S(=O)(=O)O


Isomeric SMILES

CC1=CCC2(C=C1)C(CO2)S(=O)(=O)O


InChI

InChI=1S/C9H12O4S/c1-7-2-4-9(5-3-7)8(6-13-9)14(10,11)12/h2-4,8H,5-6H2,1H3,(H,10,11,12)


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