SpectraBase Spectrum ID |
9ClSjgcfuTw |
Name |
2-Cyclohexen-1-one, 6-(acetyloxy)-2,4,4-trimethyl-3-(3-oxo-1-butenyl)-, [R-(E)]- |
CAS Registry Number |
80736-72-7 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H20O4 |
InChI |
InChI=1S/C15H20O4/c1-9(16)6-7-12-10(2)14(18)13(19-11(3)17)8-15(12,4)5/h6-7,13H,8H2,1-5H3/b7-6+/t13-/m1/s1 |
InChIKey |
BATPQHLSSCDHFO-KTRBRXNASA-N |
Molecular Weight |
264.321 g/mol |
SMILES |
C1(=C(C(=O)[C@@](CC1(C)C)(OC(=O)C)[H])C)\C=C\C(=O)C |
SPLASH |
splash10-000f-6900000000-f3c4ec072b917a08073b |
Source of Spectrum |
H-64-2431-0 |
Synonyms |
(1R)-3,5,5-trimethyl-2-oxo-4-[(1E)-3-oxo-1-butenyl]-3-cyclohexen-1-yl acetate
(R)-[3,5,5-trimethyl-2-oxo-4-(3-oxo-1-butenyl)-3-cyclohexenyl]ester of acetic acid |
Wiley ID |
1267947 |