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Reference substances

Reference substances

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General information

Inventory

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Reference substance information

IUPAC name:
4-[2-(4-{[4-(2-{4-[(phenoxycarbonyl)oxy]phenyl}propane-2-yl)phenoxycarbonyl]oxy}phenyl)propan-2-yl]phenyl phenyl carbonate

Molecular and structural information

Molecular formula:
C45H38O9
Molecular weight:
722.8
SMILES notation:
C1C=CC(=CC=1)OC(OC(=CC=C1C(C)(C)C(C=CC2OC(=O)OC(=CC=C3C(C)(C)C(C=CC4OC(=O)OC(C=CC5)=CC=5)=CC=4)C=C3)=CC=2)C=C1)=O
InChl:
InChI=1S/C45H38O9/c1-44(2,31-15-23-37(24-16-31)51-41(46)49-35-11-7-5-8-12-35)33-19-27-39(28-20-33)53-43(48)54-40-29-21-34(22-30-40)45(3,4)32-17-25-38(26-18-32)52-42(47)50-36-13-9-6-10-14-36/h5-30H,1-4H3
Structural formula:
Chemical structure