Oxotetrahydro-4H-spiro-dioxolan-prop-1-en-1-yl-1,2-phenylene Diacetate-13C3

Analyte Name

Oxotetrahydro-4H-spiro-dioxolan-prop-1-en-1-yl-1,2-phenylene Diacetate-13C3

Molecular Formula

13C3 C23 H28 O11

Molecular Weight

519.472

Accurate Mass

519.173

SMILES

CC(=O)Oc1ccc(cc1OC(=O)C)\[13C]=[13C]\[13C](=O)O[C@@H]2C[C@]3(C[C@H]4OC(C)(C)O[C@@H]24)OC(C)(C)OC3=O

InChI

InChI=1S/C26H28O11/c1-14(27)31-17-9-7-16(11-18(17)32-15(2)28)8-10-21(29)33-19-12-26(23(30)36-25(5,6)37-26)13-20-22(19)35-24(3,4)34-20/h7,9,11,19-20,22H,12-13H2,1-6H3/t19-,20-,22+,26-/m1/s1/i8+1,10+1,21+1

IUPAC

[(3'aR,4S,4'R,7'aR)-2,2,2',2'-tetramethyl-5-oxospiro[1,3-dioxolane-4,6'-4,5,7,7a-tetrahydro-3aH-1,3-benzodioxole]-4'-yl] (E)-3-(3,4-diacetyloxyphenyl)(1,2,3-13C3)prop-2-enoate

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat