| SpectraBase Spectrum ID |
B4CESexYxxg |
| Name |
Car-3-en-2-one |
| CAS Registry Number |
53585-45-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H14O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C10H14O/c1-6-4-5-7-8(9(6)11)10(7,2)3/h4,7-8H,5H2,1-3H3/t7-,8-/m0/s1 |
| InChIKey |
SAFIHMIEMQFPDA-YUMQZZPRSA-N |
| Molecular Weight |
150.221 g/mol |
| SMILES |
[C@@]12(C(C(=CC[C@@]2(C1(C)C)[H])C)=O)[H] |
| SPLASH |
splash10-0pdl-9600000000-ff082c03da92012e163b |
| Source |
ex IAN SOUTHWELL |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1886014 |
![(1S,6R)-3,7,7-TRIMETHYLBICYCLO-[4.1.0]-HEPT-3-EN-2-ONE;3-CAREN-2-ONE](/api/spectrum/B4CESexYxxg/structure.png?h=300&w=458 "(1S,6R)-3,7,7-TRIMETHYLBICYCLO-[4.1.0]-HEPT-3-EN-2-ONE;3-CAREN-2-ONE")
