SpectraBase Spectrum ID |
JJ68RpcT6bQ |
Name |
Salicylic acid isopropyl ester |
CAS Registry Number |
607-85-2 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
180.078644243 u |
Formula |
C10H12O3 |
InChI |
InChI=1S/C10H12O3/c1-7(2)13-10(12)8-5-3-4-6-9(8)11/h3-7,11H,1-2H3 |
InChIKey |
YEULQIJMIOWCHB-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
180.203 g/mol |
Nominal Mass |
180 u |
Quality |
993 |
Retention Index |
1300 |
SMILES |
OC=1C(C(OC(C)C)=O)=CC=CC1 |
SPLASH |
splash10-00di-3900000000-4323cc901320252b1f26 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
propan-2-yl 2-hydroxybenzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_003874 |