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About This Item
Empirical Formula (Hill Notation):
C9H8N2O2
CAS Number:
Molecular Weight:
176.17
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
InChI
1S/C9H8N2O2/c1-13-9(12)8-6-4-2-3-5-7(6)10-11-8/h2-5H,1H3,(H,10,11)
SMILES string
COC(=O)c1n[nH]c2ccccc12
InChI key
KWTCVAHCQGKXAZ-UHFFFAOYSA-N
assay
97%
form
solid
mp
166-171 °C
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Takahiro Doi et al.
Forensic toxicology, 36(1), 51-60 (2018-01-26)
Recently, carboxamide-type synthetic cannabinoids have been distributed globally as new psychoactive substances (NPS). Some of these compounds possess asymmetric carbon, which is derived from an amide moiety composed of amino acid derivatives (i.e., amides or esters of amino acids). In
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