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IRZGMWKRCNFGIE-VOTSOKGWSA-N
SpectraBase Compound ID 3cFBAlw6HsH
InChI InChI=1S/C17H13N/c1-2-4-14(5-3-1)6-7-15-8-9-17-13-18-11-10-16(17)12-15/h1-13H/b7-6+
InChIKey IRZGMWKRCNFGIE-VOTSOKGWSA-N
Mol Weight 231.3 g/mol
Molecular Formula C17H13N
Exact Mass 231.104799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMCTWh2mmPL
Name 6-[(E)-2-phenylethenyl]isoquinoline
Alternate Name(s) 6-[(E)-styryl]isoquinoline
Comments Less than 3 mono-isotopic peaks
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Formula C17H13N
InChI InChI=1S/C17H13N/c1-2-4-14(5-3-1)6-7-15-8-9-17-13-18-11-10-16(17)12-15/h1-13H/b7-6+
InChIKey IRZGMWKRCNFGIE-VOTSOKGWSA-N
Molecular Weight 231.298 g/mol
SMILES c1(\C=C\c2cc3ccncc3cc2)ccccc1
SPLASH splash10-001i-0090000000-86fc073478472939d9ae
Source of Spectrum KC-0-443-5
Wiley ID 825095