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3-(4a',5',6',7',8',8a'-Hexahydro-4'H-spiro[cyclohexane-1,9'-[1,2,4]triazolo[5,1-b]quinazolin]-4'-yl)propanoic acid

View entire compound with spectra: 1 MS (GC)

3-(4a',5',6',7',8',8a'-Hexahydro-4'H-spiro[cyclohexane-1,9'-[1,2,4]triazolo[5,1-b]quinazolin]-4'-yl)propanoic acid
SpectraBase Compound ID IDpCJuQNazF
InChI InChI=1S/C17H26N4O2/c22-15(23)8-11-20-14-7-3-2-6-13(14)17(9-4-1-5-10-17)21-16(20)18-12-19-21/h12-14H,1-11H2,(H,22,23)
InChIKey UPSVCZHGWPLCJA-UHFFFAOYSA-N
Mol Weight 318.42 g/mol
Molecular Formula C17H26N4O2
Exact Mass 318.205576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fRUh2HKjio
Name 3-(4a',5',6',7',8',8a'-Hexahydro-4'H-spiro[cyclohexane-1,9'-[1,2,4]triazolo[5,1-b]quinazolin]-4'-yl)propanoic acid
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Formula C17H26N4O2
InChI InChI=1S/C17H26N4O2/c22-15(23)8-11-20-14-7-3-2-6-13(14)17(9-4-1-5-10-17)21-16(20)18-12-19-21/h12-14H,1-11H2,(H,22,23)
InChIKey UPSVCZHGWPLCJA-UHFFFAOYSA-N
Molecular Weight 318.421 g/mol
SMILES OC(CCN1c2[n](C3(CCCCC3)C3C1CCCC3)ncn2)=O
SPLASH splash10-0006-9044000000-acafb5c589f2951a60c6
Source of Spectrum Y-45-1425-10
Wiley ID 1666428