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About This Item
Empirical Formula (Hill Notation):
C14H15NO7 · C6H13N
CAS Number:
Molecular Weight:
408.45
NACRES:
NA.25
PubChem Substance ID:
UNSPSC Code:
12352201
MDL number:
assay
≥98%
Quality Segment
form
powder
optical activity
[α]20/D -80.0±5.0
technique(s)
HPLC: suitable
storage temp.
−20°C
SMILES string
OC1C(OC(C(O)C1O)C(O)=O)Oc2c[nH]c3ccccc23
InChI
1S/C14H15NO7/c16-9-10(17)12(13(19)20)22-14(11(9)18)21-8-5-15-7-4-2-1-3-6(7)8/h1-5,9-12,14-18H,(H,19,20)
InChI key
KUYNOZVWCFXSNE-UHFFFAOYSA-N
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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