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Benzoic acid, 2-(bicyclo[8.3.1]tetradeca-1(14),10,12-trien-11-ylcarbonyl)-
SpectraBase Compound ID 8ILFOboN0dq
InChI InChI=1S/C22H24O3/c23-21(19-11-7-8-12-20(19)22(24)25)18-14-13-16-9-5-3-1-2-4-6-10-17(18)15-16/h7-8,11-15H,1-6,9-10H2,(H,24,25)
InChIKey AXXIRNDFJKEHPE-UHFFFAOYSA-N
Mol Weight 336.43 g/mol
Molecular Formula C22H24O3
Exact Mass 336.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 719spSJGqL
Name Benzoic acid, 2-(bicyclo[8.3.1]tetradeca-1(14),10,12-trien-11-ylcarbonyl)-
CAS Registry Number 89507-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O3
InChI InChI=1S/C22H24O3/c23-21(19-11-7-8-12-20(19)22(24)25)18-14-13-16-9-5-3-1-2-4-6-10-17(18)15-16/h7-8,11-15H,1-6,9-10H2,(H,24,25)
InChIKey AXXIRNDFJKEHPE-UHFFFAOYSA-N
Molecular Weight 336.431 g/mol
SMILES OC(c1c(C(c2c3cc(cc2)CCCCCCCC3)=O)cccc1)=O
SPLASH splash10-05r4-2931000000-67332ed3453ed226e07e
Source of Spectrum K-117-468-0
Synonyms 2-([8]metacyclophan-12-yl)benzoic acid 2-[bicyclo[8.3.1]tetradeca-1(14),10,12-trien-11-ylcarbonyl]benzoic acid Bicyclo[8.3.1]tetradecane, benzoic acid deriv.
Wiley ID 1332746