| SpectraBase Spectrum ID |
CogcYXxR2t |
| Name |
Carazolol-M 3AC |
| Classification |
Beta-Blocker |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
399.131802013 u |
| Formula |
C21H21NO7 |
| InChI |
InChI=1S/C21H21NO7/c1-12(23)26-10-15(28-13(2)24)11-27-18-8-9-19(29-14(3)25)21-20(18)16-6-4-5-7-17(16)22-21/h4-9,15,22H,10-11H2,1-3H3 |
| InChIKey |
DPTWDUNDJYCUCR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
399.399 g/mol |
| SMILES |
c12[nH]c3ccccc3c2c(OCC(OC(=O)C)COC(=O)C)ccc1OC(=O)C |
| SPLASH |
splash10-0a4j-5922000000-5e87c62288103b5227b2 |
| 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: UGLUCAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Carazolol-M (deamino-tri-HO-) 3AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_4253 |
