| SpectraBase Spectrum ID |
ExNyQUNVGZo |
| Name |
4,7-Methanoisobenzofuran-1(3H)-one, 3-ethyl-3a,4,7,7a-tetrahydro-7a-methyl-, (3.alpha.,3a.alpha.,4.alpha.,7.alpha.,7a.alpha.)- |
| Alternate Name(s) |
(1S,2R,5R,6S,7R)-5-ethyl-2-methyl-4-oxatricyclo[5.2.1.0(2,6)]dec-8-en-3-one
exo-5-ethyl-exo-2-methyl-endo-4-oxa-tricyclo[5.2.1.0**2,6]dec-8-en-3-one |
| CAS Registry Number |
93617-33-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-3-9-10-7-4-5-8(6-7)12(10,2)11(13)14-9/h4-5,7-10H,3,6H2,1-2H3/t7-,8+,9+,10+,12+/m0/s1 |
| InChIKey |
MGOWRFSAGDKMJF-PORUNHMFSA-N |
| Molecular Weight |
192.258 g/mol |
| SMILES |
C1([C@@]2([C@@]3(C=C[C@@]([C@]2([H])[C@](O1)(CC)[H])([H])C3)[H])C)=O |
| SPLASH |
splash10-014i-9000000000-9c5da43b3184b14e0b01 |
| Source of Spectrum |
F-44-2910-25 |
| Wiley ID |
1188692 |
