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(1R*,2R*)-1-Acetyl-2-methyl-3-cyclohexen-1-yl p-nitrobenzoate
SpectraBase Compound ID 3W2UTP7nPf3
InChI InChI=1S/C16H17NO5/c1-11-5-3-4-10-16(11,12(2)18)22-15(19)13-6-8-14(9-7-13)17(20)21/h3,5-9,11H,4,10H2,1-2H3/t11-,16-/m1/s1
InChIKey JERFTFURIFNBHD-BDJLRTHQSA-N
Mol Weight 303.31 g/mol
Molecular Formula C16H17NO5
Exact Mass 303.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BL24b86Fo2
Name (1R*,2R*)-1-Acetyl-2-methyl-3-cyclohexen-1-yl p-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO5
InChI InChI=1S/C16H17NO5/c1-11-5-3-4-10-16(11,12(2)18)22-15(19)13-6-8-14(9-7-13)17(20)21/h3,5-9,11H,4,10H2,1-2H3/t11-,16-/m1/s1
InChIKey JERFTFURIFNBHD-BDJLRTHQSA-N
Molecular Weight 303.314 g/mol
SMILES c1(N(=O)=O)ccc(C(O[C@@]2(C(=O)C)[C@@](C=CCC2)(C)[H])=O)cc1
SPLASH splash10-0udi-2900000000-e9ec8e30435508fe07db
Source of Spectrum F-55-14540-5
Synonyms (1R,2R)-1-acetyl-2-methyl-3-cyclohexen-1-yl 4-nitrobenzoate
Wiley ID 840203