SpectraBase Spectrum ID |
21uvoiY1tKY |
Name |
Lyral |
CAS Registry Number |
31906-04-4 |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
210.161979946 u |
Formula |
C13H22O2 |
InChI |
InChI=1S/C13H22O2/c1-13(2,15)9-3-4-11-5-7-12(10-14)8-6-11/h5,10,12,15H,3-4,6-9H2,1-2H3 |
InChIKey |
ORMHZBNNECIKOH-UHFFFAOYSA-N |
Molecular Weight |
210.317 g/mol |
Number of Peaks |
50 |
RI1 |
1671 |
RI2 |
1348 |
SMILES |
OC(CCCC1=CCC(CC1)C=O)(C)C |
SPLASH |
splash10-052f-9300000000-b8e55f1164dba4463891 |
Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
Synonyms |
3-Cyclohexene-1-carboxaldehyde, 4-(4-hydroxy-4-methylpentyl)- |
Wiley ID |
LM_FFNSC3_963 |