SpectraBase Spectrum ID |
GXyPNh42fYG |
Name |
3-Methoxy-benzoic acid propyl ester |
CAS Registry Number |
183897-90-7 |
Classification |
Pharmaceutical drug precursor |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
194.094294308 u |
Formula |
C11H14O3 |
InChI |
InChI=1S/C11H14O3/c1-3-7-14-11(12)9-5-4-6-10(8-9)13-2/h4-6,8H,3,7H2,1-2H3 |
InChIKey |
UNMOSDXZVXPNFI-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
194.230 g/mol |
Nominal Mass |
194 u |
Quality |
993 |
Retention Index |
1524 |
SMILES |
C=1(C(OCCC)=O)C=C(C=CC1)OC |
SPLASH |
splash10-0f79-3900000000-f2550e1a4665ca361276 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Propyl m-methoxybenzoate
m-Anisic acid propyl ester |
Technique |
GC/MS |
Wiley ID |
DD2024_015070 |