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5-(4-bromanylbutyl)-2-(4-methylphenyl)-4,6-dihydrocyclopenta[c]pyrrol-5-ol
SpectraBase Compound ID LqxQYfqMmRI
InChI InChI=1S/C18H22BrNO/c1-14-4-6-17(7-5-14)20-12-15-10-18(21,8-2-3-9-19)11-16(15)13-20/h4-7,12-13,21H,2-3,8-11H2,1H3
InChIKey QCPUFZVTUMHHPZ-UHFFFAOYSA-N
Mol Weight 348.28 g/mol
Molecular Formula C18H22BrNO
Exact Mass 347.088477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoOlO0aagHz
Name 5-(4-bromanylbutyl)-2-(4-methylphenyl)-4,6-dihydrocyclopenta[c]pyrrol-5-ol
Alternate Name(s) 5-(4-bromobutyl)-2-(4-methylphenyl)-4,6-dihydrocyclopenta[c]pyrrol-5-ol 5-(4-bromobutyl)-2-(p-tolyl)-4,6-dihydrocyclopenta[c]pyrrol-5-ol
Comments Less than 3 mono-isotopic peaks
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Formula C18H22BrNO
InChI InChI=1S/C18H22BrNO/c1-14-4-6-17(7-5-14)20-12-15-10-18(21,8-2-3-9-19)11-16(15)13-20/h4-7,12-13,21H,2-3,8-11H2,1H3
InChIKey QCPUFZVTUMHHPZ-UHFFFAOYSA-N
Molecular Weight 348.284 g/mol
SMILES OC1(Cc2c[n](cc2C1)-c1ccc(cc1)C)CCCCBr
SPLASH splash10-001i-0900000000-d93723738226945e86a1
Source of Spectrum K1-2003-780-18
Wiley ID 1520772