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1-Formyl-[2.2]paracyclophane-1,9-diene
SpectraBase Compound ID 7sBxsr8H0rP
InChI InChI=1S/C17H12O/c18-12-17-11-15-5-3-13(4-6-15)1-2-14-7-9-16(17)10-8-14/h1-12H/b2-1-,13-1-,14-2-,15-11-,17-11-,17-16+
InChIKey IOHGFXYLBIIPSS-BLTGSUTOSA-N
Mol Weight 232.28 g/mol
Molecular Formula C17H12O
Exact Mass 232.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LR3VpHa0bhv
Name 1-Formyl-[2.2]paracyclophane-1,9-diene
Alternate Name(s) tricyclo[8.2.2.2(4,7)]hexadeca-1(12),2,4,6,8,10,13,15-octaene-2-carbaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C17H12O
InChI InChI=1S/C17H12O/c18-12-17-11-15-5-3-13(4-6-15)1-2-14-7-9-16(17)10-8-14/h1-12H/b2-1-,13-1-,14-2-,15-11-,17-11-,17-16+
InChIKey IOHGFXYLBIIPSS-BLTGSUTOSA-N
Molecular Weight 232.282 g/mol
SMILES c12\C=C/(c3ccc(\C=C/c(cc2)cc1)cc3)C=O
SPLASH splash10-0f89-0090000000-7f91945f2b2dcfe5f06c
Source of Spectrum U1-1998-1767-3
Wiley ID 751571