| SpectraBase Spectrum ID |
B3Df1eyISZc |
| Name |
Butylparaben |
| CAS Registry Number |
94-26-8 |
| Classification |
Preservative |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); 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/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3 |
| InChIKey |
QFOHBWFCKVYLES-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
194.230 g/mol |
| Nominal Mass |
194 u |
| Quality |
951 |
| Retention Index |
1709 |
| SMILES |
OC=1C=CC(C(OCCCC)=O)=CC1 |
| SPLASH |
splash10-0079-2900000000-c3ee545a122613005d3b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Nipabutyl
Butyl 4-hydroxy benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007003 |
