SpectraBase Spectrum ID |
2p6PqaZSeP2 |
Name |
Cyclopropylmethyl-p-toluate |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
190.099379689 u |
Formula |
C12H14O2 |
InChI |
InChI=1S/C12H14O2/c1-9-2-6-11(7-3-9)12(13)14-8-10-4-5-10/h2-3,6-7,10H,4-5,8H2,1H3 |
InChIKey |
IQNAABQFNMPUNR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
190.242 g/mol |
Nominal Mass |
190 u |
Quality |
992 |
Retention Index |
1517 |
SMILES |
C1(C(OCC2CC2)=O)=CC=C(C=C1)C |
SPLASH |
splash10-014i-9800000000-10eaf9868708af8bddf7 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
cyclopropylmethyl 4-methylbenzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_010331 |