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4-Benzoyl-13-benzyl-[2.2]paracyclophane
SpectraBase Compound ID 6QBh8MrRO1k
InChI InChI=1S/C30H26O/c31-30(27-9-5-2-6-10-27)29-21-24-12-11-23-13-15-25(17-18-26(29)16-14-24)28(20-23)19-22-7-3-1-4-8-22/h1-10,13-16,20-21H,11-12,17-19H2
InChIKey FPYLEYWFLOGMSV-UHFFFAOYSA-N
Mol Weight 402.54 g/mol
Molecular Formula C30H26O
Exact Mass 402.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4XlxWGshzu
Name 4-Benzoyl-13-benzyl-[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H26O
InChI InChI=1S/C30H26O/c31-30(27-9-5-2-6-10-27)29-21-24-12-11-23-13-15-25(17-18-26(29)16-14-24)28(20-23)19-22-7-3-1-4-8-22/h1-10,13-16,20-21H,11-12,17-19H2
InChIKey FPYLEYWFLOGMSV-UHFFFAOYSA-N
Molecular Weight 402.537 g/mol
SMILES c1(C(=O)c2ccccc2)c2CCc3c(Cc4ccccc4)cc(CCc(c1)cc2)cc3
SPLASH splash10-0ftf-0930300000-cf4b1a90fb8a1530d1df
Source of Spectrum H-2005-3268-10
Synonyms [12-benzyltricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl](phenyl)methanone
Wiley ID 1563116