| SpectraBase Spectrum ID |
5sNBL3kulPK |
| Name |
(1RS,2RS,5SR,8RS)-4-Hydroxymethylene-7,7-dimethyl-5-(2-propenyl)tricyclo[3.3.0.0(2,8)]octan-3-one |
| Alternate Name(s) |
(1Z)-4a-allyl-1-(hydroxymethylene)-3,3-dimethylhexahydrocyclopropa[cd]pentalen-2(1H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O2 |
| InChI |
InChI=1S/C14H18O2/c1-4-5-14-7-13(2,3)10-9(11(10)14)12(16)8(14)6-15/h4,6,9-11,15H,1,5,7H2,2-3H3/b8-6+ |
| InChIKey |
LGUWREIBUCCCRZ-SOFGYWHQSA-N |
| Molecular Weight |
218.296 g/mol |
| SMILES |
O\C=C\1C2(C3C(C1=O)C3C(C)(C)C2)CC=C |
| SPLASH |
splash10-014i-9000000000-4e4c4f49f9847d724a6b |
| Source of Spectrum |
E1-37-3115-0 |
| Wiley ID |
1518023 |
![(1RS,2RS,5SR,8RS)-4-Hydroxymethylene-7,7-dimethyl-5-(2-propenyl)tricyclo[3.3.0.0(2,8)]octan-3-one](/api/spectrum/5sNBL3kulPK/structure.png?h=300&w=458 "(1RS,2RS,5SR,8RS)-4-Hydroxymethylene-7,7-dimethyl-5-(2-propenyl)tricyclo[3.3.0.0(2,8)]octan-3-one")
