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N-[2',5'-di(t-Butyl)phenyl]perylene-3,4,9-tricarboxylic acid - 3,4-Imide
SpectraBase Compound ID 3Q1zPOHY3Jp
InChI InChI=1S/C37H31NO4/c1-36(2,3)19-10-17-28(37(4,5)6)29(18-19)38-33(39)26-15-12-23-20-8-7-9-21-25(35(41)42)14-11-22(30(20)21)24-13-16-27(34(38)40)32(26)31(23)24/h7-18H,1-6H3,(H,41,42)
InChIKey VFZYGMFSDHQUKN-UHFFFAOYSA-N
Mol Weight 553.7 g/mol
Molecular Formula C37H31NO4
Exact Mass 553.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kkgfb9XypMT
Name N-[2',5'-di(t-Butyl)phenyl]perylene-3,4,9-tricarboxylic acid - 3,4-Imide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H31NO4
InChI InChI=1S/C37H31NO4/c1-36(2,3)19-10-17-28(37(4,5)6)29(18-19)38-33(39)26-15-12-23-20-8-7-9-21-25(35(41)42)14-11-22(30(20)21)24-13-16-27(34(38)40)32(26)31(23)24/h7-18H,1-6H3,(H,41,42)
InChIKey VFZYGMFSDHQUKN-UHFFFAOYSA-N
Molecular Weight 553.658 g/mol
SMILES OC(c1ccc2c3c1cccc3c1c3c4c(C(N(C(c4cc1)=O)c1c(ccc(c1)C(C)(C)C)C(C)(C)C)=O)ccc23)=O
SPLASH splash10-0002-0000900000-0eb9db109477e336f2d6
Source of Spectrum K1-2001-609-2
Wiley ID 846670