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Carbamic acid, N-methyl-N-heptyl-, 3-chloropropyl ester
SpectraBase Compound ID FgY5VEXrpt3
InChI InChI=1S/C12H24ClNO2/c1-3-4-5-6-7-10-14(2)12(15)16-11-8-9-13/h3-11H2,1-2H3
InChIKey LQCFUSAKGNPZSQ-UHFFFAOYSA-N
Mol Weight 249.78 g/mol
Molecular Formula C12H24ClNO2
Exact Mass 249.149557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GfjrhcgGIMQ
Name Carbamic acid, N-methyl-N-heptyl-, 3-chloropropyl ester
Comments Computed using HOSE algorithm
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Exact Mass 249.149556715 u
Formula C12H24ClNO2
InChI InChI=1S/C12H24ClNO2/c1-3-4-5-6-7-10-14(2)12(15)16-11-8-9-13/h3-11H2,1-2H3
InChIKey LQCFUSAKGNPZSQ-UHFFFAOYSA-N
Molecular Weight 249.782 g/mol
SMILES C(OCCCCl)(=O)N(C)CCCCCCC