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4-Carboxy-13-(4,4-dimethyloxazolin-2-yl)[2,2]paracyclophane

View entire compound with spectra: 1 MS (GC)

4-Carboxy-13-(4,4-dimethyloxazolin-2-yl)[2,2]paracyclophane
SpectraBase Compound ID F72llxF5ODA
InChI InChI=1S/C22H23NO3/c1-22(2)13-26-20(23-22)18-11-14-3-4-15-6-8-17(19(12-15)21(24)25)10-9-16(18)7-5-14/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,24,25)
InChIKey RQURKWMSXZQVFP-UHFFFAOYSA-N
Mol Weight 349.43 g/mol
Molecular Formula C22H23NO3
Exact Mass 349.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfEOrKFiuZJ
Name 4-Carboxy-13-(4,4-dimethyloxazolin-2-yl)[2,2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO3
InChI InChI=1S/C22H23NO3/c1-22(2)13-26-20(23-22)18-11-14-3-4-15-6-8-17(19(12-15)21(24)25)10-9-16(18)7-5-14/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,24,25)
InChIKey RQURKWMSXZQVFP-UHFFFAOYSA-N
Molecular Weight 349.430 g/mol
SMILES OC(c1c2CCc3c(C4=NC(C)(C)CO4)cc(cc3)CCc(c1)cc2)=O
SPLASH splash10-0zfs-0798000000-c79dc973554159f84ba0
Source of Spectrum F-56-7336-16
Wiley ID 858395