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4,5,6-Methenocyclopentapyrazole, 3,3a,4,5,6,6a-hexahydro-3,3-diphenyl-, cis-
SpectraBase Compound ID 8KqVX2IT29N
InChI InChI=1S/C19H16N2/c1-3-7-11(8-4-1)19(12-9-5-2-6-10-12)17-15-13-14(15)16(13)18(17)20-21-19/h1-10,13-18H/t13-,14+,15?,16?,17?,18?
InChIKey CECZYVMLNBWQSF-CAPWYDJASA-N
Mol Weight 272.35 g/mol
Molecular Formula C19H16N2
Exact Mass 272.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21xP6wkxEMs
Name 4,5,6-Methenocyclopentapyrazole, 3,3a,4,5,6,6a-hexahydro-3,3-diphenyl-, cis-
CAS Registry Number 77429-83-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N2
InChI InChI=1S/C19H16N2/c1-3-7-11(8-4-1)19(12-9-5-2-6-10-12)17-15-13-14(15)16(13)18(17)20-21-19/h1-10,13-18H/t13-,14+,15?,16?,17?,18?
InChIKey CECZYVMLNBWQSF-CAPWYDJASA-N
Molecular Weight 272.351 g/mol
SMILES [C@@]12([C@@]3([H])C2C2N=NC(C2C13)(c1ccccc1)c1ccccc1)[H]
SPLASH splash10-014i-0930000000-14e1b5d0cc0ff82a2574
Source of Spectrum F-45-2912-2
Synonyms (3R,4S)-9,9-diphenyl-7,8-diazatetracyclo[4.3.0.0(2,4).0(3,5)]non-7-ene cis-3,3a,4,5,6,6a-hexahydro-4,5,6-methenocyclopentapyrazoles
Wiley ID 1276680