SpectraBase Spectrum ID |
JpGPWiETCtv |
Name |
(R,E)-5-(1,3-dioxolan-2-yl)-4-methylpent-2-enal |
Appearance |
Pale yellow pungent oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
170.094294308 u |
Formula |
C9H14O3 |
InChI |
InChI=1S/C9H14O3/c1-8(3-2-4-10)7-9-11-5-6-12-9/h2-4,8-9H,5-7H2,1H3/b3-2+/t8-/m0/s1 |
InChIKey |
JCBRYEUPKZEUKC-SGJFDWMWSA-N |
Instrument Name |
Finnigan MAT 8200 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201808937 |
Molecular Weight |
170.208 g/mol |
Optical Rotation |
[a]D20 = -59.5 (c = 0.79, CHCl3) |
Quality |
93 |
Reported Formula |
C9H14O3 |
SMILES |
C1(OCCO1)C[C@](\C=C\C=O)(C)[H] |
SPLASH |
splash10-00di-9000000000-b91bcc03469f9e19f725 |
Source of Spectrum |
ACI-57-SM18-28 (DOI: 10.1002/anie.201808937) |
Wiley ID |
1893504 |