| SpectraBase Spectrum ID |
1xuatVRMLQK |
| Name |
trans/cis-(3R*,8aR*/S*)-3,8a-Dihydro-3,8a-dimethylazulen-1-(2H)-one |
| Alternate Name(s) |
(3S)-3,8a-dimethyl-3,8a-dihydro-1(2H)-azulenone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O |
| InChI |
InChI=1S/C12H14O/c1-9-8-11(13)12(2)7-5-3-4-6-10(9)12/h3-7,9H,8H2,1-2H3/t9-,12?/m0/s1 |
| InChIKey |
ANZMZRGJDCBNHD-QHGLUPRGSA-N |
| Molecular Weight |
174.243 g/mol |
| SMILES |
C12(C([C@@](C)(CC2=O)[H])=CC=CC=C1)C |
| SPLASH |
splash10-000x-6900000000-8bff4b756a89371e6e69 |
| Source of Spectrum |
J-66-7176-33 |
| Wiley ID |
1536135 |
