Annotation Hits
N
Screening or library annotations
Compound
Monobutyl phthalate
NSID
NS00006195
SMILES
CCCCOC(=O)C1=C(C=CC=C1)C(O)=O
InChI
InChI=1S/C12H14O4/c1-2-3-8-16-12(15)10-7-5-4-6-9(10)11(13)14/h4-7H,2-3,8H2,1H3,(H,13,14)
InChIKey
YZBOVSFWWNVKRJ-UHFFFAOYSA-N
CAS Number
131-70-4
2D Structure
RDKit depiction
See compound in other scientific sites:
References
N
Literature / database references
Patents
N
Patent records mentioning this compound
Monoisotopic Mass
N
Placeholder value (update later)
Temporal stripes
Literature stripe
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Patent stripe
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3D Structure
Interactive 3D view based on an RDKit ETKDG conformer (auto-loaded).