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[(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]carbamate
SpectraBase Compound ID EvvcVhVVXXb
InChI InChI=1S/C17H31NO4/c1-11(2)14-7-6-12(3)8-15(14)21-16(19)18-9-13-10-20-17(4,5)22-13/h11-15H,6-10H2,1-5H3,(H,18,19)/t12-,13?,14+,15+/m1/s1
InChIKey ITXSVQXDMGLVEG-URLJDCLXSA-N
Mol Weight 313.44 g/mol
Molecular Formula C17H31NO4
Exact Mass 313.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rTy4bGa6N
Name [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]carbamate
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Formula C17H31NO4
InChI InChI=1S/C17H31NO4/c1-11(2)14-7-6-12(3)8-15(14)21-16(19)18-9-13-10-20-17(4,5)22-13/h11-15H,6-10H2,1-5H3,(H,18,19)/t12-,13?,14+,15+/m1/s1
InChIKey ITXSVQXDMGLVEG-URLJDCLXSA-N
Ionization Type EI
Molecular Weight 313.438 g/mol
SMILES N(CC1OC(OC1)(C)C)C(=O)O[C@@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H]
SPLASH splash10-0udi-5900000000-4d7501dcc3eddadb728e
Source of Spectrum EP2135516B1
Wiley ID 1844990