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(1R,2R)-3,4-diphenylcyclobut-3-ene-1,2-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 1uPprIHiePr
InChI InChI=1S/C20H18O4/c1-23-19(21)17-15(13-9-5-3-6-10-13)16(18(17)20(22)24-2)14-11-7-4-8-12-14/h3-12,17-18H,1-2H3/t17-,18-/m0/s1
InChIKey YMKHVVDDGXKZHN-ROUUACIJSA-N
Mol Weight 322.36 g/mol
Molecular Formula C20H18O4
Exact Mass 322.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UFmw9Rgctm
Name (1R,2R)-3,4-diphenylcyclobut-3-ene-1,2-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl (1R,2R)-3,4-diphenylcyclobut-3-ene-1,2-dicarboxylate
CAS Registry Number 53432-83-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O4
InChI InChI=1S/C20H18O4/c1-23-19(21)17-15(13-9-5-3-6-10-13)16(18(17)20(22)24-2)14-11-7-4-8-12-14/h3-12,17-18H,1-2H3/t17-,18-/m0/s1
InChIKey YMKHVVDDGXKZHN-ROUUACIJSA-N
Molecular Weight 322.360 g/mol
SMILES C1(=C(c2ccccc2)[C@@]([C@]1(C(=O)OC)[H])(C(=O)OC)[H])c1ccccc1
SPLASH splash10-0ikc-0291000000-ebaa8ecf808d6eaa37b2
Source of Spectrum J-40-494-0
Wiley ID 1321895