SpectraBase Spectrum ID |
9IM9QOraOjA |
Name |
Non-(2E)-enoic acid ester |
Source of Sample |
SAFC Cat.no. W272507 |
CAS Registry Number |
111-79-5 |
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 |
170.130679818 u |
Formula |
C10H18O2 |
InChI |
InChI=1S/C10H18O2/c1-3-4-5-6-7-8-9-10(11)12-2/h8-9H,3-7H2,1-2H3/b9-8+ |
InChIKey |
ZWNPUELCBZVMDA-CMDGGOBGSA-N |
Molecular Weight |
170.252 g/mol |
Number of Peaks |
50 |
RI1 |
1272 |
RI2 |
950 |
RI3 |
1000 |
RI4 |
956 |
RI5 |
1252 |
SMILES |
C(\C=C\CCCCCC)(=O)OC |
SPLASH |
splash10-0a4u-9100000000-bfaffdc7191cac45264e |
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 |
2-Nonenoic acid, methyl ester |
Wiley ID |
LM_FFNSC3_1127 |