SpectraBase Spectrum ID |
JHSw78MdCrI |
Name |
Cyclopropylmethyl 4-ethyl benzoate |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
204.115029753 u |
Formula |
C13H16O2 |
InChI |
InChI=1S/C13H16O2/c1-2-10-5-7-12(8-6-10)13(14)15-9-11-3-4-11/h5-8,11H,2-4,9H2,1H3 |
InChIKey |
AGMOMHBXSRFOFR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
204.269 g/mol |
Nominal Mass |
204 u |
Quality |
813 |
Retention Index |
1520 |
SMILES |
C1(C(OCC2CC2)=O)=CC=C(C=C1)CC |
SPLASH |
splash10-001i-3900000000-f3f2d5e8f31b4cfd4540 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
cyclopropylmethyl 4-ethylbenzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_015663 |