Analyte Name

Antioxidant 1098-13C12

CAS Number

2724654-01-5

Molecular Formula

13C12 C28 H64 N2 O4

Molecular Weight

648.859

Accurate Mass

648.527

SMILES

CC(C)(C)[13c]1[13cH][13c](CCC(=O)NCCCCCCNC(=O)CC[13c]2[13cH][13c]([13c](O)[13c]([13cH]2)C(C)(C)C)C(C)(C)C)[13cH][13c]([13c]1O)C(C)(C)C

InChI

InChI=1S/C40H64N2O4/c1-37(2,3)29-23-27(24-30(35(29)45)38(4,5)6)17-19-33(43)41-21-15-13-14-16-22-42-34(44)20-18-28-25-31(39(7,8)9)36(46)32(26-28)40(10,11)12/h23-26,45-46H,13-22H2,1-12H3,(H,41,43)(H,42,44)/i23+1,24+1,25+1,26+1,27+1,28+1,29+1,30+1,31+1,32+1,35+1,36+1

IUPAC

3-(3,5-ditert-butyl-4-hydroxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)-N-[6-[3-(3,5-ditert-butyl-4-hydroxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)propanoylamino]hexyl]propanamide

Unlabelled CAS Number

23128-74-7

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat