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(S)-2,3-dimethylphenyl 3-(2-(2,3-dimethylphenoxy)-2-oxoethylidene)-4-(diphenylmethylene)-2,2-diphenylcyclobutanecarboxylate

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(S)-2,3-dimethylphenyl 3-(2-(2,3-dimethylphenoxy)-2-oxoethylidene)-4-(diphenylmethylene)-2,2-diphenylcyclobutanecarboxylate
SpectraBase Compound ID FioAanLdsQ0
InChI InChI=1S/C48H40O4/c1-32-19-17-29-41(34(32)3)51-43(49)31-40-45(44(36-21-9-5-10-22-36)37-23-11-6-12-24-37)46(47(50)52-42-30-18-20-33(2)35(42)4)48(40,38-25-13-7-14-26-38)39-27-15-8-16-28-39/h5-31,46H,1-4H3/b40-31+/t46-/m1/s1
InChIKey MQGWVNROMWBTHF-MPZNXRMLSA-N
Mol Weight 680.8 g/mol
Molecular Formula C48H40O4
Exact Mass 680.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TXRErXW8BZ
Name (S)-2,3-dimethylphenyl 3-(2-(2,3-dimethylphenoxy)-2-oxoethylidene)-4-(diphenylmethylene)-2,2-diphenylcyclobutanecarboxylate
Alternate Name(s) (S,E)-2,3-dimethylphenyl 3-(2-(2,3-dimethylphenoxy)-2-oxoethylidene)-4-(diphenylmethylene)-2,2-diphenylcyclobutanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H40O4
InChI InChI=1S/C48H40O4/c1-32-19-17-29-41(34(32)3)51-43(49)31-40-45(44(36-21-9-5-10-22-36)37-23-11-6-12-24-37)46(47(50)52-42-30-18-20-33(2)35(42)4)48(40,38-25-13-7-14-26-38)39-27-15-8-16-28-39/h5-31,46H,1-4H3/b40-31+/t46-/m1/s1
InChIKey MQGWVNROMWBTHF-MPZNXRMLSA-N
Literature Reference DOI 10.1002/prac.19973390142
Molecular Weight 680.844 g/mol
SMILES C1([C@](C(\C1=C\C(=O)Oc1c(c(ccc1)C)C)=C(c1ccccc1)c1ccccc1)(C(=O)Oc1cccc(c1C)C)[H])(c1ccccc1)c1ccccc1
SPLASH splash10-0ac0-0903100000-f332b75b176fc9445233
Source of Spectrum JF-399-241-10d
Wiley ID 1768361