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Tricyclo[9.2.2.2*4,7*]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaene-6-carboxylic acid
SpectraBase Compound ID 6nY59VcKZ7E
InChI InChI=1S/C18H18O2/c19-18(20)17-12-15-9-8-14-6-4-13(5-7-14)2-1-3-16(17)11-10-15/h4-7,10-12H,1-3,8-9H2,(H,19,20)
InChIKey BLXXOYVHAQGEEH-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C18H18O2
Exact Mass 266.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Asd9mu2Cm
Name Tricyclo[9.2.2.2*4,7*]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaene-6-carboxylic acid
Alternate Name(s) [3.2]paracyclophane-5-carboxylic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O2
InChI InChI=1S/C18H18O2/c19-18(20)17-12-15-9-8-14-6-4-13(5-7-14)2-1-3-16(17)11-10-15/h4-7,10-12H,1-3,8-9H2,(H,19,20)
InChIKey BLXXOYVHAQGEEH-UHFFFAOYSA-N
Molecular Weight 266.340 g/mol
SMILES OC(c1c2ccc(c1)CCc1ccc(CCC2)cc1)=O
SPLASH splash10-066r-0920000000-803a2752db0ea2bde84c
Source of Spectrum U1-2009-234-30
Wiley ID 1662384