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3,3-Dimethyl-1,2-diphenylcyclopropane-trans-1,2-diyl diacetate
SpectraBase Compound ID BozeGrM14bh
InChI InChI=1S/C21H22O4/c1-15(22)24-20(17-11-7-5-8-12-17)19(3,4)21(20,25-16(2)23)18-13-9-6-10-14-18/h5-14H,1-4H3/t20-,21-/m0/s1
InChIKey SRADEIKUCMVJEL-SFTDATJTSA-N
Mol Weight 338.4 g/mol
Molecular Formula C21H22O4
Exact Mass 338.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6wUNjKhjsS
Name 3,3-Dimethyl-1,2-diphenylcyclopropane-trans-1,2-diyl diacetate
Alternate Name(s) (1S,2S)-2-(acetyloxy)-3,3-dimethyl-1,2-diphenylcyclopropyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O4
InChI InChI=1S/C21H22O4/c1-15(22)24-20(17-11-7-5-8-12-17)19(3,4)21(20,25-16(2)23)18-13-9-6-10-14-18/h5-14H,1-4H3/t20-,21-/m0/s1
InChIKey SRADEIKUCMVJEL-SFTDATJTSA-N
Molecular Weight 338.403 g/mol
SMILES [C@@]1([C@](OC(=O)C)(c2ccccc2)C1(C)C)(OC(=O)C)c1ccccc1
SPLASH splash10-0a4l-7930000000-3e5404d8b49db96f7262
Source of Spectrum JA-50-309-0
Wiley ID 1333994