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N-(1,4-Dimethyl-5,7-diphenyl-1,2,3,4-tetrahydro-6H-cyclopenta[b]pyrazin-6-ylidene)-2-(1H-indol-3-yl)ethan-1-aminium tetrafluoroborate
SpectraBase Compound ID LhltZ9i1Fd8
InChI InChI=1S/C31H30N4.BF4/c1-34-19-20-35(2)31-28(23-13-7-4-8-14-23)29(27(30(31)34)22-11-5-3-6-12-22)32-18-17-24-21-33-26-16-10-9-15-25(24)26;2-1(3,4)5/h3-16,21,33H,17-20H2,1-2H3;/q;-1/p+1
InChIKey ZPBIENPGAHQJFC-UHFFFAOYSA-O
Mol Weight 546.4 g/mol
Molecular Formula C31H31BF4N4
Exact Mass 546.25779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uYXg7Pm0Wu
Name N-(1,4-Dimethyl-5,7-diphenyl-1,2,3,4-tetrahydro-6H-cyclopenta[b]pyrazin-6-ylidene)-2-(1H-indol-3-yl)ethan-1-aminium tetrafluoroborate
Appearance Dark blue foam
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 546.257789836 u
Formula C31H31BF4N4
InChI InChI=1S/C31H30N4.BF4/c1-34-19-20-35(2)31-28(23-13-7-4-8-14-23)29(27(30(31)34)22-11-5-3-6-12-22)32-18-17-24-21-33-26-16-10-9-15-25(24)26;2-1(3,4)5/h3-16,21,33H,17-20H2,1-2H3;/q;-1/p+1
InChIKey ZPBIENPGAHQJFC-UHFFFAOYSA-O
Instrument Name FINNIGAN SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102959
Molecular Weight 546.421 g/mol
Quality 47
Reported Formula C31H31N4BF4
SMILES [NH+](=C1C(=C2C(N(CCN2C)C)=C1C1=CC=CC=C1)C1=CC=CC=C1)CCC=1C2=C(C=CC=C2)NC1.[B-](F)(F)(F)F
SPLASH splash10-001r-9100000000-06ddcdf9cdc6eba052b1
Source of Spectrum QE-27-SM3-L7g (DOI: 10.1002/chem.202102959)
Wiley ID 1904209