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(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl-2-(1H-indol-3-Yl)-acetate
SpectraBase Compound ID 42nHfHglbxi
InChI InChI=1S/C20H27NO2/c1-13(2)16-9-8-14(3)10-19(16)23-20(22)11-15-12-21-18-7-5-4-6-17(15)18/h4-7,12-14,16,19,21H,8-11H2,1-3H3/t14-,16+,19-/m1/s1
InChIKey VJHINTYMUMFPSV-SIXWZSSISA-N
Mol Weight 313.44 g/mol
Molecular Formula C20H27NO2
Exact Mass 313.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvlzRdDL2vT
Name (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl-2-(1H-indol-3-Yl)-acetate
Alternate Name(s) (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 2-(1H-indol-3-yl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO2
InChI InChI=1S/C20H27NO2/c1-13(2)16-9-8-14(3)10-19(16)23-20(22)11-15-12-21-18-7-5-4-6-17(15)18/h4-7,12-14,16,19,21H,8-11H2,1-3H3/t14-,16+,19-/m1/s1
InChIKey VJHINTYMUMFPSV-SIXWZSSISA-N
Molecular Weight 313.441 g/mol
SMILES [nH]1c2c(c(c1)CC(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)cccc2
SPLASH splash10-001i-0902000000-49e913d1e92d5e4da32c
Source of Spectrum QC-23-1288-4a
Wiley ID 1738816