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1(2H)-Naphthalenone, 7-(9-acridinyl)-2-[[3,5-bis(1,1-dimethylethyl)phenyl]methylene]-3,4-dihydro-
SpectraBase Compound ID 6aulu6GAast
InChI InChI=1S/C38H37NO/c1-37(2,3)28-20-24(21-29(23-28)38(4,5)6)19-27-18-16-25-15-17-26(22-32(25)36(27)40)35-30-11-7-9-13-33(30)39-34-14-10-8-12-31(34)35/h7-15,17,19-23H,16,18H2,1-6H3/b27-19+
InChIKey KJIAMSBLUUXZEI-ZXVVBBHZSA-N
Mol Weight 523.7 g/mol
Molecular Formula C38H37NO
Exact Mass 523.287515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSolJd4isaY
Name 1(2H)-Naphthalenone, 7-(9-acridinyl)-2-[[3,5-bis(1,1-dimethylethyl)phenyl]methylene]-3,4-dihydro-
Alternate Name(s) (2E)-7-(9-acridinyl)-2-(3,5-ditert-butylbenzylidene)-3,4-dihydro-1(2H)-naphthalenone 2-(3,5-di-tert-butylbenzylidene)-7-(9-acridinyl)-1-oxo-1,2,3,4-tetrahydonaphthalene
CAS Registry Number 118656-13-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H37NO
InChI InChI=1S/C38H37NO/c1-37(2,3)28-20-24(21-29(23-28)38(4,5)6)19-27-18-16-25-15-17-26(22-32(25)36(27)40)35-30-11-7-9-13-33(30)39-34-14-10-8-12-31(34)35/h7-15,17,19-23H,16,18H2,1-6H3/b27-19+
InChIKey KJIAMSBLUUXZEI-ZXVVBBHZSA-N
Molecular Weight 523.720 g/mol
SMILES C1(\C(=C\c2cc(C(C)(C)C)cc(c2)C(C)(C)C)CCc2c1cc(-c1c3c(cccc3)nc3c1cccc3)cc2)=O
SPLASH splash10-014i-0000920000-df11a5c047ff5eb5a863
Source of Spectrum C-111-1379-5
Wiley ID 1402426