N-[(Hydroxycarbonyl)decamethylene]perylene-3,4 -dicarboxylic acid - 3,4-imide - Optional[MS (GC)] - Spectrum

SpectraBase Compound ID	2XTZhH5XIuW
InChI	InChI=1S/C33H31NO4/c35-28(36)15-7-5-3-1-2-4-6-8-20-34-32(37)26-18-16-24-22-13-9-11-21-12-10-14-23(29(21)22)25-17-19-27(33(34)38)31(26)30(24)25/h9-14,16-19H,1-8,15,20H2,(H,35,36)
InChIKey	OCFLJXNDWCXPBE-UHFFFAOYSA-N Google Search
Mol Weight	505.6 g/mol
Molecular Formula	C33H31NO4
Exact Mass	505.225308 g/mol

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SpectraBase Spectrum ID	7IyZz46pbuj
Name	N-[(Hydroxycarbonyl)decamethylene]perylene-3,4 -dicarboxylic acid - 3,4-imide
Alternate Name(s)	11-(1,3-dioxo-1H-benzo[10,5]anthra[2,1,9-def]isoquinolin-2(3H)-yl)undecanoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C33H31NO4
InChI	InChI=1S/C33H31NO4/c35-28(36)15-7-5-3-1-2-4-6-8-20-34-32(37)26-18-16-24-22-13-9-11-21-12-10-14-23(29(21)22)25-17-19-27(33(34)38)31(26)30(24)25/h9-14,16-19H,1-8,15,20H2,(H,35,36)
InChIKey	OCFLJXNDWCXPBE-UHFFFAOYSA-N
Molecular Weight	505.614 g/mol
SMILES	OC(CCCCCCCCCCN1C(c2ccc3c4c2c(C1=O)ccc4c1c2c(cccc32)ccc1)=O)=O
SPLASH	splash10-0ab9-0019180000-284cb19e073bf1dd0378
Source of Spectrum	U1-1998-850-5
Wiley ID	751229