| SpectraBase Spectrum ID |
2AKq2sJHlK2 |
| Name |
1(3H)-Isobenzofuranone, 3-cyclopentyl-3a,4,7,7a-tetrahydro-, (3.alpha.,3a.alpha.,7a.alpha.)- |
| Alternate Name(s) |
(3R,3aS,7aR)-3-cyclopentyl-3a,4,7,7a-tetrahydro-2-benzofuran-1(3H)-one
cis (3,3a)-3-cyclopentyl-cis(3a,7a)-3a,4,7,7a-tetrahydro-3(H)-isobenzofuran-1-one |
| CAS Registry Number |
97181-91-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c14-13-11-8-4-3-7-10(11)12(15-13)9-5-1-2-6-9/h3-4,9-12H,1-2,5-8H2/t10-,11+,12+/m0/s1 |
| InChIKey |
CFVCWBJMKIVXEX-QJPTWQEYSA-N |
| Molecular Weight |
206.285 g/mol |
| SMILES |
C1(O[C@@]([C@]2(CC=CC[C@@]12[H])[H])(C1CCCC1)[H])=O |
| SPLASH |
splash10-004i-9000000000-d9268fb9529b96aa5c08 |
| Source of Spectrum |
F-41-3702-13 |
| Wiley ID |
1204716 |
