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(3R,5R,8S)-Menthyl-2-(2-iodophenyl)acetate
SpectraBase Compound ID ADnzQUDDGlZ
InChI InChI=1S/C18H25IO2/c1-12(2)15-9-8-13(3)10-17(15)21-18(20)11-14-6-4-5-7-16(14)19/h4-7,12-13,15,17H,8-11H2,1-3H3/t13?,15?,17-/m1/s1
InChIKey OGDFRPPDCHXXOX-PUJMQQBBSA-N
Mol Weight 400.3 g/mol
Molecular Formula C18H25IO2
Exact Mass 400.089925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0QoRNUjlpb
Name (3R,5R,8S)-Menthyl-2-(2-iodophenyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25IO2
InChI InChI=1S/C18H25IO2/c1-12(2)15-9-8-13(3)10-17(15)21-18(20)11-14-6-4-5-7-16(14)19/h4-7,12-13,15,17H,8-11H2,1-3H3/t13?,15?,17-/m1/s1
InChIKey OGDFRPPDCHXXOX-PUJMQQBBSA-N
Molecular Weight 400.300 g/mol
SMILES [C@@]1(OC(Cc2c(I)cccc2)=O)(C(CCC(C1)C)C(C)C)[H]
SPLASH splash10-0536-9530100000-563c8d823c99e3bfb7a9
Source of Spectrum U1-2008-5324-22
Wiley ID 1710594