SpectraBase Spectrum ID |
CdkGU62AXBG |
Name |
Sclareolate |
Source of Sample |
Standard L'Oreal |
CAS Registry Number |
319002-92-1 |
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 |
202.156894565 u |
Formula |
C11H22O3 |
InChI |
InChI=1S/C11H22O3/c1-6-8-13-10(12)9(3)14-11(4,5)7-2/h9H,6-8H2,1-5H3 |
InChIKey |
KPUAQAYQMYWKBV-UHFFFAOYSA-N |
Molecular Weight |
202.294 g/mol |
Number of Peaks |
50 |
RI1 |
1205 |
RI2 |
883 |
SMILES |
CC(CC)(OC(C(=O)OCCC)C)C |
SPLASH |
splash10-00dl-9100000000-874ad5869f21aab920f5 |
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 |
Propanoic acid, 2-(1,1-dimethylpropoxy)-, propyl ester |
Wiley ID |
LM_FFNSC3_3071 |