| SpectraBase Spectrum ID |
FZFd7mbYasq |
| Name |
(RS)-1,6-Bis(1-hydroxyprop-2-ynyl)cyclohepta-1,3,5-triene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12O2 |
| InChI |
InChI=1S/C13H12O2/c1-3-12(14)10-7-5-6-8-11(9-10)13(15)4-2/h1-2,5-8,12-15H,9H2/t12-,13+ |
| InChIKey |
INBCFBCNXAMHJJ-BETUJISGSA-N |
| Molecular Weight |
200.237 g/mol |
| SMILES |
O[C@@](C=1CC([C@](C#C)(O)[H])=CC=CC1)(C#C)[H] |
| SPLASH |
splash10-0udi-0910000000-81b77197b0d372dc5c69 |
| Source of Spectrum |
KC-0-1462-15 |
| Synonyms |
1-[6-(1-hydroxy-2-propynyl)-1,3,5-cycloheptatrien-1-yl]-2-propyn-1-ol
(1R)-1-[6-[(1S)-1-hydroxyprop-2-ynyl]-1-cyclohepta-1,3,5-trienyl]-2-propyn-1-ol
(1R)-1-[6-[(1S)-1-oxidanylprop-2-ynyl]cyclohepta-1,3,5-trien-1-yl]prop-2-yn-1-ol |
| Wiley ID |
781327 |
