SpectraBase Spectrum ID |
8FnbaI0Tlaq |
Name |
1-Hexen-3-one,5-methyl-1-phenyl |
CAS Registry Number |
2892-18-4 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
188.120115134 u |
Formula |
C13H16O |
InChI |
InChI=1S/C13H16O/c1-11(2)10-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+ |
InChIKey |
LLVCDRTZBYXKII-CMDGGOBGSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
188.270 g/mol |
Nominal Mass |
188 u |
Quality |
977 |
Retention Index |
1370 |
SMILES |
C=1(\C=C\C(CC(C)C)=O)C=CC=CC1 |
SPLASH |
splash10-001i-2900000000-7437b2afdd165d4d0eae |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
5-Methyl-1-phenylhex-1-en-3-one |
Technique |
GC/MS |
Wiley ID |
DD2024_029622 |