| SpectraBase Spectrum ID |
C29T772tC4e |
| Name |
2-[(4-nitrophenyl)-oxidanyl-methyl]cyclohex-2-en-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13NO4 |
| InChI |
InChI=1S/C13H13NO4/c15-12-4-2-1-3-11(12)13(16)9-5-7-10(8-6-9)14(17)18/h3,5-8,13,16H,1-2,4H2 |
| InChIKey |
MTNHTQZZUUIZKF-UHFFFAOYSA-N |
| Molecular Weight |
247.250 g/mol |
| SMILES |
OC(C=1C(CCCC1)=O)c1ccc(cc1)N(=O)=O |
| SPLASH |
splash10-001i-0090000000-4f75832f27e08776da63 |
| Source of Spectrum |
U1-2002-3672-1 |
| Synonyms |
2-[hydroxy-(4-nitrophenyl)methyl]-1-cyclohex-2-enone
2-[hydroxy-(4-nitrophenyl)methyl]cyclohex-2-en-1-one |
| Wiley ID |
1523439 |
![2-[(4-nitrophenyl)-oxidanyl-methyl]cyclohex-2-en-1-one](/api/spectrum/C29T772tC4e/structure.png?h=300&w=458 "2-[(4-nitrophenyl)-oxidanyl-methyl]cyclohex-2-en-1-one")
