SpectraBase Spectrum ID |
C3u2NPHGAXN |
Name |
Thiophene <2-formyl-, 5-methyl-> |
Source of Sample |
SAFC Cat.no. W320900 |
CAS Registry Number |
13679-70-4 |
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 |
126.013935986 u |
Formula |
C6H6OS |
InChI |
InChI=1S/C6H6OS/c1-5-2-3-6(4-7)8-5/h2-4H,1H3 |
InChIKey |
VAUMDUIUEPIGHM-UHFFFAOYSA-N |
Molecular Weight |
126.173 g/mol |
Number of Peaks |
50 |
RI1 |
1120 |
RI2 |
797 |
SMILES |
c1(ccc(s1)C)C=O |
SPLASH |
splash10-004i-7900000000-8619f9a0aa4a8c46bf30 |
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-Thiophenecarboxaldehyde, 5-methyl- |
Wiley ID |
LM_FFNSC3_765 |