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N-(1,4-Dimethyl-5,7-diphenyl-1,2,3,4-tetrahydro-6H-cyclopenta[b]pyrazin-6-ylidene)-2-phenylethan-1-aminium tetrafluoroborate
SpectraBase Compound ID GlR7XiLSlQ5
InChI InChI=1S/C29H29N3.BF4/c1-31-20-21-32(2)29-26(24-16-10-5-11-17-24)27(30-19-18-22-12-6-3-7-13-22)25(28(29)31)23-14-8-4-9-15-23;2-1(3,4)5/h3-17H,18-21H2,1-2H3;/q;-1/p+1
InChIKey HXYUHWBRTYIZRO-UHFFFAOYSA-O
Mol Weight 507.4 g/mol
Molecular Formula C29H30BF4N3
Exact Mass 507.246891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ktd2kK05iTV
Name N-(1,4-Dimethyl-5,7-diphenyl-1,2,3,4-tetrahydro-6H-cyclopenta[b]pyrazin-6-ylidene)-2-phenylethan-1-aminium tetrafluoroborate
Appearance Dark blue foam
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 507.246890800 u
Formula C29H30BF4N3
InChI InChI=1S/C29H29N3.BF4/c1-31-20-21-32(2)29-26(24-16-10-5-11-17-24)27(30-19-18-22-12-6-3-7-13-22)25(28(29)31)23-14-8-4-9-15-23;2-1(3,4)5/h3-17H,18-21H2,1-2H3;/q;-1/p+1
InChIKey HXYUHWBRTYIZRO-UHFFFAOYSA-O
Instrument Name FINNIGAN SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102959
Molecular Weight 507.384 g/mol
Quality 72
Reported Formula C29H30N3BF4
SMILES [NH+](=C1C(=C2C(N(CCN2C)C)=C1C1=CC=CC=C1)C1=CC=CC=C1)CCC1=CC=CC=C1.[B-](F)(F)(F)F
SPLASH splash10-0f97-0930000000-711c758145443293a53b
Source of Spectrum QE-27-SM2-L7d (DOI: 10.1002/chem.202102959)
Wiley ID 1904207