| SpectraBase Spectrum ID |
1LOJaV1Zr3b |
| Name |
PYRENE, 1-NITRO- |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
247.063328532 u |
| Formula |
C16H9NO2 |
| InChI |
InChI=1S/C16H9NO2/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H |
| InChIKey |
ALRLPDGCPYIVHP-UHFFFAOYSA-N |
| Molecular Weight |
247.253 g/mol |
| Nominal Mass |
247 u |
| Number of Peaks |
76 |
| SMILES |
c1c2cccc3c2c2c(cc3)c(N(=O)=O)ccc2c1 |
| SPLASH |
splash10-0udi-2790000000-83e4e90df1cabab81b77 |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Wiley ID |
MVX001405 |
