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Temazepam, tbdms derivative
SpectraBase Compound ID 2Kmy4cPGpZg
InChI InChI=1S/C22H27ClN2O2Si/c1-22(2,3)28(5,6)27-20-21(26)25(4)18-13-12-16(23)14-17(18)19(24-20)15-10-8-7-9-11-15/h7-14,20H,1-6H3
InChIKey JKSMOLSDAWSXTF-UHFFFAOYSA-N
Mol Weight 415.01 g/mol
Molecular Formula C22H27ClN2O2Si
Exact Mass 414.153032 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HwxHUwKTRDq
Name Temazepam, tbdms derivative
Comments Computed using HOSE algorithm
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Exact Mass 414.153032350 u
Formula C22H27ClN2O2Si
InChI InChI=1S/C22H27ClN2O2Si/c1-22(2,3)28(5,6)27-20-21(26)25(4)18-13-12-16(23)14-17(18)19(24-20)15-10-8-7-9-11-15/h7-14,20H,1-6H3
InChIKey JKSMOLSDAWSXTF-UHFFFAOYSA-N
Molecular Weight 415.008 g/mol
SMILES C1=2N(C(C(N=C(C2C=C(Cl)C=C1)C1=CC=CC=C1)O[Si](C(C)(C)C)(C)C)=O)C