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89063

Supelco

4-Bromo-α-cyanocinnamic acid

matrix substance for MALDI-MS, ≥95.0% (HPLC)

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Synonym(s):
3-(4-Bromophenyl)-2-cyano-2-propenoic acid, p-Bromo-α-cyanocinnamic acid, p-Bromobenzylidenecyanoacetic acid, BrCCA
Empirical Formula (Hill Notation):
C10H6BrNO2
CAS Number:
339548-64-0
Molecular Weight:
252.06
MDL number:
MFCD07798953
UNSPSC Code:
12000000
PubChem Substance ID:
329769692
NACRES:
NA.21

grade

matrix substance for MALDI-MS

Quality Level

100

Assay

≥95.0% (HPLC)

form

powder

analyte functional class(es)

drugs of abuse, ionic liquids (quantification)

analyte chemical class(es)

chlorinated lipids, lipids, peptides, phospholipids, phosphopeptides

technique(s)

MALDI-MS: suitable

solubility

methanol: 100 mg/10 mL, clear, colorless to light yellow

SMILES string

OC(/C(C#N)=C/C1=CC=C(Br)C=C1)=O

InChI

1S/C10H6BrNO2/c11-9-3-1-7(2-4-9)5-8(6-12)10(13)14/h1-5H,(H,13,14)/b8-5+

InChI key

REWONLOPJHWIMK-VMPITWQZSA-N

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  • suitable as MALDI-Matrix material
  • suitable for collision-induced dissociation MS/MS (CID-MS/MS)

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Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Certificates of Analysis (COA)

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