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5-tert-Butylcyanometbylen-)-5H-cyclopenta(cd)phenalen
SpectraBase Compound ID xeWS6qNKee
InChI InChI=1S/C21H17N/c1-21(2,3)18(12-22)16-10-8-15-7-6-13-4-5-14-9-11-17(16)20(15)19(13)14/h4-11H,1-3H3/b18-16+
InChIKey UOGVJPNIOLHJRF-FBMGVBCBSA-N
Mol Weight 283.37 g/mol
Molecular Formula C21H17N
Exact Mass 283.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TLSuA1s0lp
Name 5-tert-Butylcyanometbylen-)-5H-cyclopenta(cd)phenalen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17N
InChI InChI=1S/C21H17N/c1-21(2,3)18(12-22)16-10-8-15-7-6-13-4-5-14-9-11-17(16)20(15)19(13)14/h4-11H,1-3H3/b18-16+
InChIKey UOGVJPNIOLHJRF-FBMGVBCBSA-N
Literature Reference DOI 10.1002/ardp.19813140111
Molecular Weight 283.374 g/mol
SMILES c1c2c3c4c(c1)C=C\C(c4ccc3C=C2)=C\(C#N)C(C)(C)C
SPLASH splash10-0udi-0690000000-ef8c36b60e245985c37c
Source of Spectrum APC-314-60-4
Synonyms (Z)-2-(5H-cyclopenta[cd]phenalen-5-ylidene)-3,3-dimethylbutanenitrile
Wiley ID 1787886