SpectraBase Spectrum ID |
7PckBB4yup1 |
Name |
Romilat |
CAS Registry Number |
104468-21-5 |
Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
170.130679818 u |
Formula |
C10H18O2 |
InChI |
InChI=1S/C10H18O2/c1-8(2)6-7-12-9(11)10(3,4)5/h1,6-7H2,2-5H3 |
InChIKey |
FJEBKWNPJIZWKJ-UHFFFAOYSA-N |
Molecular Weight |
170.252 g/mol |
Number of Peaks |
50 |
RI1 |
1051 |
RI2 |
724 |
RI3 |
869 |
RI4 |
825 |
RI5 |
1038 |
SMILES |
CC(C(=O)OCCC(=C)C)(C)C |
SPLASH |
splash10-066r-9000000000-fc1bcf2e930a35bd7f45 |
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, 2,2-dimethyl-, 3-methyl-3-buten-1-yl ester |
Wiley ID |
LM_FFNSC3_3309 |