SpectraBase Spectrum ID |
JFyslgrfEkS |
Name |
Helional |
CAS Registry Number |
1205-17-0 |
Classification |
Fragrance |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
192.078644243 u |
Formula |
C11H12O3 |
InChI |
InChI=1S/C11H12O3/c1-8(6-12)4-9-2-3-10-11(5-9)14-7-13-10/h2-3,5-6,8H,4,7H2,1H3 |
InChIKey |
BOPPSUHPZARXTH-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
192.214 g/mol |
Nominal Mass |
192 u |
Quality |
997 |
Retention Index |
1467 |
SMILES |
C1=2C(=CC(CC(C=O)C)=CC2)OCO1 |
SPLASH |
splash10-000i-3900000000-7c85a298f5f3ac5daaf3 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
alpha-Methyl-3,4-(methylenedioxy)hydrocinnamaldehyde |
Technique |
GC/MS |
Wiley ID |
DD2024_027665 |