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About This Item
Linear Formula:
C6H4(CH2CH2CO2H)2
CAS Number:
Molecular Weight:
222.24
NACRES:
NA.23
PubChem Substance ID:
UNSPSC Code:
12162002
EC Number:
224-215-6
MDL number:
InChI key
DFOCUWFSRVQSNI-UHFFFAOYSA-N
InChI
1S/C12H14O4/c13-11(14)7-5-9-1-2-10(4-3-9)6-8-12(15)16/h1-4H,5-8H2,(H,13,14)(H,15,16)
SMILES string
OC(=O)CCc1ccc(CCC(O)=O)cc1
assay
98%
form
solid
mp
231-234 °C (lit.)
Related Categories
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
Regulatory Information
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Elissia T Franklin et al.
Analytical and bioanalytical chemistry, 411(19), 4739-4749 (2019-01-08)
Shotgun lipid analysis based on electrospray ionization-tandem mass spectrometry (ESI-MS/MS) is increasingly used in lipidomic studies. One challenge for the shotgun approach is the discrimination of lipid isomers and isobars. Gas-phase charge inversion via ion/ion reactions has been used as
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