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Sarcosine, N-(4-trifluoromethylbenzoyl)-, hexadecyl ester

View entire compound with spectra: 1 NMR

Sarcosine, N-(4-trifluoromethylbenzoyl)-, hexadecyl ester
SpectraBase Compound ID AsiXrnaFsjb
InChI InChI=1S/C27H42F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-34-25(32)22-31(2)26(33)23-17-19-24(20-18-23)27(28,29)30/h17-20H,3-16,21-22H2,1-2H3
InChIKey NCNYCOAUIVWPDS-UHFFFAOYSA-N
Mol Weight 485.6 g/mol
Molecular Formula C27H42F3NO3
Exact Mass 485.311679 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2EfSXjpkEW3
Name Sarcosine, N-(4-trifluoromethylbenzoyl)-, hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 485.311678702 u
Formula C27H42F3NO3
InChI InChI=1S/C27H42F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-34-25(32)22-31(2)26(33)23-17-19-24(20-18-23)27(28,29)30/h17-20H,3-16,21-22H2,1-2H3
InChIKey NCNYCOAUIVWPDS-UHFFFAOYSA-N
Molecular Weight 485.632 g/mol
SMILES C(CCCCOC(CN(C(=O)C1=CC=C(C=C1)C(F)(F)F)C)=O)CCCCCCCCCCC