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[(E)-triacont-21-en-13-yl] hydrogen sulfate

[(E)-triacont-21-en-13-yl] hydrogen sulfate

Systemtic Name:[(E)-triacont-21-en-13-yl] hydrogen sulfate
Openeye Name:[(E)-1-dodecyloctadec-9-enyl] hydrogen sulfate
CAS Name:sulfuric acid [(E)-triacont-21-en-13-yl] ester
IUPAC Name:[(E)-triacont-21-en-13-yl] hydrogen sulfate
Traditional Name:sulfuric acid [(E)-1-lauryloctadec-9-enyl] ester
Formula: C30H60O4S
MolecularWeight: 516.86
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCC=CCCCCCCCC)OS(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCC/C=C/CCCCCCCC)OS(=O)(=O)O


InChI

InChI=1S/C30H60O4S/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-30(34-35(31,32)33)28-26-24-22-20-14-12-10-8-6-4-2/h16-17,30H,3-15,18-29H2,1-2H3,(H,31,32,33)/b17-16+


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