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(Q82673192)
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English
1-[4-(3-Azidopropoxy)-5-methoxy-2-nitrophenyl]ethan-1-one
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
294.096419548
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₄N₄O₅
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canonical SMILES
CC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OCCCN=[N+]=[N-])OC
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Identifiers
InChI
InChI=1S/C12H14N4O5/c1-8(17)9-6-11(20-2)12(7-10(9)16(18)19)21-5-3-4-14-15-13/h6-7H,3-5H2,1-2H3
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InChIKey
PLZVFCUQALAXRM-UHFFFAOYSA-N
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CAS Registry Number
872578-74-0
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PubChem CID
58966174
1 reference
matched by identifier from
InChIKey
InChIKey
PLZVFCUQALAXRM-UHFFFAOYSA-N
UniChem compound ID
65835192
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30730727
1 reference
matched by identifier from
InChIKey
InChIKey
PLZVFCUQALAXRM-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20681471
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