SpectraBase Spectrum ID |
4lQBouTZ5oZ |
Name |
Colchicine |
CAS Registry Number |
64-86-8 |
Classification |
Alkaloid
Uricosuric |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
399.168187523 u |
Formula |
C22H25NO6 |
InChI |
InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24) |
InChIKey |
IAKHMKGGTNLKSZ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
399.443 g/mol |
SMILES |
COC1=CC=C2c3c(OC)c(OC)c(OC)cc3CCC(C2=CC1=O)NC(C)=O |
SPLASH |
splash10-03dj-0289000000-2b8509ee5362f6a43ada |
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. |
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_2852 |