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Sarcosine, N-(4-chlorobenzoyl)-, dodecyl ester

View entire compound with spectra: 1 NMR

Sarcosine, N-(4-chlorobenzoyl)-, dodecyl ester
SpectraBase Compound ID FxzHF5ToACf
InChI InChI=1S/C22H34ClNO3/c1-3-4-5-6-7-8-9-10-11-12-17-27-21(25)18-24(2)22(26)19-13-15-20(23)16-14-19/h13-16H,3-12,17-18H2,1-2H3
InChIKey APPPTNVALNXEJO-UHFFFAOYSA-N
Mol Weight 396.0 g/mol
Molecular Formula C22H34ClNO3
Exact Mass 395.222722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 64QNVnkWzGw
Name Sarcosine, N-(4-chlorobenzoyl)-, dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 395.222721656 u
Formula C22H34ClNO3
InChI InChI=1S/C22H34ClNO3/c1-3-4-5-6-7-8-9-10-11-12-17-27-21(25)18-24(2)22(26)19-13-15-20(23)16-14-19/h13-16H,3-12,17-18H2,1-2H3
InChIKey APPPTNVALNXEJO-UHFFFAOYSA-N
Molecular Weight 395.971 g/mol
SMILES C(C1=CC=C(C=C1)Cl)(=O)N(CC(=O)OCCCCCCCCCCCC)C