| SpectraBase Compound ID | 2nt47FumaXb |
|---|---|
| InChI | InChI=1S/C24H24O3/c1-27-23(26)24(13-15-8-9-16-4-2-5-17(16)10-15)14-20-11-18-6-3-7-19(18)12-21(20)22(24)25/h8-12H,2-7,13-14H2,1H3 |
| InChIKey | OJPPMCOCOQWCNP-UHFFFAOYSA-N |
| Mol Weight | 360.45 g/mol |
| Molecular Formula | C24H24O3 |
| Exact Mass | 360.172545 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4ioBPEjRom3 |
|---|---|
| Name | 2-(2,3-dihydro-1H-inden-5-ylmethyl)-3-oxo-1,5,6,7-tetrahydro-s-indacene-2-carboxylic acid methyl ester |
| CAS Registry Number | 117460-33-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H24O3 |
| InChI | InChI=1S/C24H24O3/c1-27-23(26)24(13-15-8-9-16-4-2-5-17(16)10-15)14-20-11-18-6-3-7-19(18)12-21(20)22(24)25/h8-12H,2-7,13-14H2,1H3 |
| InChIKey | OJPPMCOCOQWCNP-UHFFFAOYSA-N |
| Molecular Weight | 360.453 g/mol |
| SMILES | C1(C(c2cc3CCCc3cc2C1)=O)(C(=O)OC)Cc1cc2CCCc2cc1 |
| SPLASH | splash10-0f6t-0609000000-b8e1420e039604be24f1 |
| Source of Spectrum | AH-119-640-12 |
| Synonyms | 2-(indan-5-ylmethyl)-3-keto-1,5,6,7-tetrahydro-s-indacene-2-carboxylic acid methyl ester Methyl 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-oxo-1,2,3,5,6,7-hexahydro-s-indacene-2-carboxylate Methyl 2-(2,3-dihydro-1H-inden-5-ylmethyl)-3-oxidanylidene-1,5,6,7-tetrahydro-s-indacene-2-carboxylate Methyl 2-(2,3-dihydro-1H-inden-5-ylmethyl)-3-oxo-1,5,6,7-tetrahydro-s-indacene-2-carboxylate Methyl 2-(indan-5-ylmethyl)-3-oxo-1,5,6,7-tetrahydro-s-indacene-2-carboxylate |
| Wiley ID | 1348686 |