Analyte Name

Sodium 4-((E)-((1SR,4SR)-7,7-dimethyl-3-oxo-4-(sulfomethyl)bicyclo[2.2.1]heptan-2-ylidene)methyl)-benzaldehyde

Molecular Formula

C18 H19 O5 S . Na

Molecular Weight

370.395

Accurate Mass

370.085

SMILES

[Na+].CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)[O-])C(=O)/C/2=C\c3ccc(C=O)cc3

InChI

InChI=1S/C18H20O5S.Na/c1-17(2)15-7-8-18(17,11-24(21,22)23)16(20)14(15)9-12-3-5-13(10-19)6-4-12;/h3-6,9-10,15H,7-8,11H2,1-2H3,(H,21,22,23);/q;+1/p-1/b14-9-;/t15-,18-;/m1./s1

IUPAC

sodium;[(1S,3Z,4S)-3-[(4-formylphenyl)methylidene]-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat