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2-[8-(4-Chlorophenyl)-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazin-6-yl]benzoic acid
SpectraBase Compound ID 36ysZzCLleL
InChI InChI=1S/C20H16ClNO3/c21-14-7-5-13(6-8-14)17-11-18(22-9-10-25-12-19(17)22)15-3-1-2-4-16(15)20(23)24/h1-8,11H,9-10,12H2,(H,23,24)
InChIKey PZGCESIRLAUGTD-UHFFFAOYSA-N
Mol Weight 353.81 g/mol
Molecular Formula C20H16ClNO3
Exact Mass 353.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7JLsqFN1I5
Name 2-[8-(4-Chlorophenyl)-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]oxazin-6-yl]benzoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C20H16ClNO3
InChI InChI=1S/C20H16ClNO3/c21-14-7-5-13(6-8-14)17-11-18(22-9-10-25-12-19(17)22)15-3-1-2-4-16(15)20(23)24/h1-8,11H,9-10,12H2,(H,23,24)
InChIKey PZGCESIRLAUGTD-UHFFFAOYSA-N
Molecular Weight 353.805 g/mol
SMILES OC(c1c(cccc1)-c1[n]2c(COCC2)c(c1)-c1ccc(cc1)Cl)=O
SPLASH splash10-0udi-0009000000-8fd80a3b99863e5f1c01
Source of Spectrum F-69-4924-17
Wiley ID 1595323