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Benzene, 4-[(3,4-dimethoxyphenyl)dimethylcyclobutyl]-1,2-dimethoxy-
SpectraBase Compound ID 1cSvuYqH6R7
InChI InChI=1S/C22H28O4/c1-13-14(2)22(16-8-10-18(24-4)20(12-16)26-6)21(13)15-7-9-17(23-3)19(11-15)25-5/h7-14,21-22H,1-6H3/t13-,14-,21-,22+/m1/s1
InChIKey IOTXFXWARGNLEJ-SRLQQUAWSA-N
Mol Weight 356.46 g/mol
Molecular Formula C22H28O4
Exact Mass 356.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6u7wW1lt4rG
Name Benzene, 4-[(3,4-dimethoxyphenyl)dimethylcyclobutyl]-1,2-dimethoxy-
Alternate Name(s) Bis-(3,4-dimethoxyphenyl)-dimethylcyclobutane 1-cis-2-bis (3,4-dimethoxyphenyl)-trans-3,trans-4-dimethylcyclobutane 4-[(1S,2R,3R,4R)-2-(3,4-dimethoxyphenyl)-3,4-dimethylcyclobutyl]-1,2-dimethoxybenzene
CAS Registry Number 58037-90-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O4
InChI InChI=1S/C22H28O4/c1-13-14(2)22(16-8-10-18(24-4)20(12-16)26-6)21(13)15-7-9-17(23-3)19(11-15)25-5/h7-14,21-22H,1-6H3/t13-,14-,21-,22+/m1/s1
InChIKey IOTXFXWARGNLEJ-SRLQQUAWSA-N
Molecular Weight 356.462 g/mol
SMILES [C@]1([C@@](c2cc(OC)c(cc2)OC)([C@@]([C@]1(C)[H])(C)[H])[H])(c1cc(OC)c(cc1)OC)[H]
SPLASH splash10-004i-0900000000-7f00218f04cde87c1a97
Source of Spectrum SB-29-1008-0
Wiley ID 1346042