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3a,6a-dimethyl-3,6-diphenyl-1,3a,4,6a-tetrahydropentalene
SpectraBase Compound ID FfBOvsPisVo
InChI InChI=1S/C22H22/c1-21-15-13-20(18-11-7-4-8-12-18)22(21,2)16-14-19(21)17-9-5-3-6-10-17/h3-14H,15-16H2,1-2H3
InChIKey DFLQKDVNYYWRPM-UHFFFAOYSA-N
Mol Weight 286.42 g/mol
Molecular Formula C22H22
Exact Mass 286.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yig0sOo68U
Name 3a,6a-dimethyl-3,6-diphenyl-1,3a,4,6a-tetrahydropentalene
CAS Registry Number 139040-27-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22
InChI InChI=1S/C22H22/c1-21-15-13-20(18-11-7-4-8-12-18)22(21,2)16-14-19(21)17-9-5-3-6-10-17/h3-14H,15-16H2,1-2H3
InChIKey DFLQKDVNYYWRPM-UHFFFAOYSA-N
Molecular Weight 286.418 g/mol
SMILES C12(C(=CCC2(C(=CC1)c1ccccc1)C)c1ccccc1)C
SPLASH splash10-00kr-2490000000-b76f5adfb08406c90cde
Source of Spectrum U-1992-509-13
Synonyms 3a,6a-dimethyl-3,6-diphenyl-1,4-dihydropentalene
Wiley ID 764166