SpectraBase Spectrum ID |
DFIFDkhlVSO |
Name |
Spiro[acridine-9(10H),9'(10'H)-anthracen]-10'-one, 2,7-dimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
387.162314299 u |
Formula |
C28H21NO |
InChI |
InChI=1S/C28H21NO/c1-17-11-13-25-23(15-17)28(24-16-18(2)12-14-26(24)29-25)21-9-5-3-7-19(21)27(30)20-8-4-6-10-22(20)28/h3-16,29H,1-2H3 |
InChIKey |
WNSIOXDKFQUDAW-UHFFFAOYSA-N |
Molecular Weight |
387.482 g/mol |
SMILES |
C12(C=3C(=CC=C(C3)C)NC3=C1C=C(C=C3)C)C1=C(C=CC=C1)C(C=1C2=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.835254 |