SpectraBase Spectrum ID |
DxFXjFz3Zv |
Name |
Propofol |
CAS Registry Number |
2078-54-8 |
Classification |
Anesthetic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
178.135765199 u |
Formula |
C12H18O |
InChI |
InChI=1S/C12H18O/c1-8(2)10-6-5-7-11(9(3)4)12(10)13/h5-9,13H,1-4H3 |
InChIKey |
OLBCVFGFOZPWHH-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
178.275 g/mol |
SMILES |
c1c(c(O)c(C(C)C)cc1)C(C)C |
SPLASH |
splash10-03di-2900000000-4d824f118889eb7b2e12 |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Sample Preparation Procedure |
Detected: G P U |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_3305 |