| SpectraBase Spectrum ID |
3E6utAH4x8H |
| Name |
(11,12,12-trideuterio)-9,10-Dihydro-9,10-ethanoanthracene-11-carboxylic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H11D3O2 |
| InChI |
InChI=1S/C17H14O2/c18-17(19)15-9-14-10-5-1-3-7-12(10)16(15)13-8-4-2-6-11(13)14/h1-8,14-16H,9H2,(H,18,19)/i9D2,15D |
| InChIKey |
LZKBBIGRPXLMRB-SMNVOWQRSA-N |
| Molecular Weight |
253.315 g/mol |
| SMILES |
OC(C1(C2c3c(cccc3)C(c3c2cccc3)C1([2D])[2D])[2D])=O |
| SPLASH |
splash10-004i-0900000000-8247a0a92bc30d6f2250 |
| Source of Spectrum |
B-52-667-0 |
| Wiley ID |
746512 |
