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(3-Isopropoxy-propyl)-carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester
SpectraBase Compound ID EtBx4BUN71a
InChI InChI=1S/C17H33NO3/c1-12(2)15-8-7-14(5)11-16(15)21-17(19)18-9-6-10-20-13(3)4/h12-16H,6-11H2,1-5H3,(H,18,19)/t14-,15+,16-/m1/s1
InChIKey ZFHICMRFWBTYAJ-OWCLPIDISA-N
Mol Weight 299.5 g/mol
Molecular Formula C17H33NO3
Exact Mass 299.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KcwklpcbK
Name (3-Isopropoxy-propyl)-carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H33NO3
InChI InChI=1S/C17H33NO3/c1-12(2)15-8-7-14(5)11-16(15)21-17(19)18-9-6-10-20-13(3)4/h12-16H,6-11H2,1-5H3,(H,18,19)/t14-,15+,16-/m1/s1
InChIKey ZFHICMRFWBTYAJ-OWCLPIDISA-N
Ionization Type EI
Molecular Weight 299.455 g/mol
SMILES N(C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)CCCOC(C)C
SPLASH splash10-100r-9700000000-9610a1bc9b55625f06a4
Source of Spectrum WO2010089421A2
Wiley ID 1842853