SpectraBase Spectrum ID |
GY4gKK43iJE |
Name |
Cicletanine |
CAS Registry Number |
89943-82-8 |
Classification |
Pharmaceutical drug, antihypertonic, diuretic |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
261.055656328 u |
Formula |
C14H12ClNO2 |
InChI |
InChI=1S/C14H12ClNO2/c1-8-13(17)12-7-18-14(11(12)6-16-8)9-2-4-10(15)5-3-9/h2-6,14,17H,7H2,1H3 |
InChIKey |
CVKNDPRBJVBDSS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
261.708 g/mol |
Nominal Mass |
261 u |
Quality |
759 |
Retention Index |
2033 |
SMILES |
OC1=C2C(C(C=3C=CC(=CC3)Cl)OC2)=CN=C1C |
SPLASH |
splash10-03dr-2960000000-2385b892cd2341f9b81f |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
3-(4-Chlorophenyl)-6-methyl-1,3-dihydrofuro[4,3-d]pyridin-7-ol |
Technique |
GC/MS |
Wiley ID |
DD2024_007853 |