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Methyl 3-(p-nitrophenyl)bicyclo[1.1.1]pentane-1-carboxylate
SpectraBase Compound ID IvBJNiRVsA4
InChI InChI=1S/C13H13NO4/c1-18-11(15)13-6-12(7-13,8-13)9-2-4-10(5-3-9)14(16)17/h2-5H,6-8H2,1H3
InChIKey AECUFRKDHDXVBL-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Qalgn7wHpQ
Name Methyl 3-(p-nitrophenyl)bicyclo[1.1.1]pentane-1-carboxylate
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Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-18-11(15)13-6-12(7-13,8-13)9-2-4-10(5-3-9)14(16)17/h2-5H,6-8H2,1H3
InChIKey AECUFRKDHDXVBL-UHFFFAOYSA-N
Molecular Weight 247.250 g/mol
SMILES C12(CC(C2)(c2ccc(N(=O)=O)cc2)C1)C(=O)OC
SPLASH splash10-002f-2900000000-0479a972cf8d1aebe1e3
Source of Spectrum C-116-11997-0
Synonyms Methyl 3-(4-nitrophenyl)bicyclo[1.1.1]pentane-1-carboxylate
Wiley ID 1249947