| SpectraBase Spectrum ID |
EELQVvxPOiI |
| Name |
Propan-2-one |
| CAS Registry Number |
3027-13-2 |
| 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 |
164.083729624 u |
| Formula |
C10H12O2 |
| InChI |
InChI=1S/C10H12O2/c1-8(11)6-9-4-3-5-10(7-9)12-2/h3-5,7H,6H2,1-2H3 |
| InChIKey |
RMMRRRLPDBJBQL-UHFFFAOYSA-N |
| Molecular Weight |
164.204 g/mol |
| Number of Peaks |
50 |
| RI1 |
1386 |
| RI2 |
1146 |
| RI3 |
1458 |
| RI4 |
1498 |
| SMILES |
C(C(=O)C)c1cc(ccc1)OC |
| SPLASH |
splash10-006x-9600000000-4f030d11230e5e0783ec |
| 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-Propanone, 1-(3-methoxyphenyl)- |
| Wiley ID |
LM_FFNSC3_1942 |
