Analyte Name

N-Fmoc-(13C9,15N)-L-Tyrosine O-Tertbutyl Ether

CAS Number

1217442-53-9

Molecular Formula

13C9 C19 H29 15N O5

Molecular Weight

469.461

Accurate Mass

469.232

SMILES

CC(C)(C)O[13c]1[13cH][13cH][13c]([13CH2][13C@H]([15NH]C(=O)OCC2c3ccccc3c4ccccc24)[13C](=O)O)[13cH][13cH]1

InChI

InChI=1S/C28H29NO5/c1-28(2,3)34-19-14-12-18(13-15-19)16-25(26(30)31)29-27(32)33-17-24-22-10-6-4-8-20(22)21-9-5-7-11-23(21)24/h4-15,24-25H,16-17H2,1-3H3,(H,29,32)(H,30,31)/t25-/m0/s1/i12+1,13+1,14+1,15+1,16+1,18+1,19+1,25+1,26+1,29+1

IUPAC

(2S)-2-(9H-fluoren-9-ylmethoxycarbonyl(15N)amino)-3-[4-[(2-methylpropan-2-yl)oxy](1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl](1,2,3-13C3)propanoic acid

Unlabelled CAS Number

71989-38-3

SIL Type

Carbon, Nitrogen

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat