SpectraBase Spectrum ID |
KPDOQ5z9Sj7 |
Name |
2-Buten-1-one, 1-(6,7,7-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-1-yl)-, [1R-[1.alpha.(E),4.beta.]]- |
CAS Registry Number |
56083-37-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H18O3 |
InChI |
InChI=1S/C13H18O3/c1-5-6-11(14)13-9(2)7-10(15-16-13)8-12(13,3)4/h5-7,10H,8H2,1-4H3/b6-5+/t10-,13-/m1/s1 |
InChIKey |
XPNBBTUSYWTRDD-KOIHBYQTSA-N |
Molecular Weight |
222.284 g/mol |
SMILES |
C\C=C\C(=O)[C@]12OO[C@@](CC2(C)C)(C=C1C)[H] |
SPLASH |
splash10-014l-9000000000-76da33d4504e95b9411e |
Source of Spectrum |
H-56-2031-2 |
Synonyms |
(2E)-1-(6,7,7-Trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-1-yl)-2-buten-1-one
(E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)-2-buten-1-one
(E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)but-2-en-1-one |
Wiley ID |
1222546 |