SpectraBase Spectrum ID |
2mSIaDCqeOG |
Name |
Butinoline |
CAS Registry Number |
968-63-8 |
Classification |
Pharmaceutical drug, spasmolytic |
Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
291.162314299 u |
Formula |
C20H21NO |
InChI |
InChI=1S/C20H21NO/c22-20(18-10-3-1-4-11-18,19-12-5-2-6-13-19)14-9-17-21-15-7-8-16-21/h1-6,10-13,22H,7-8,15-17H2 |
InChIKey |
LWPXJPFOEPMIRG-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
291.394 g/mol |
Nominal Mass |
291 u |
Quality |
896 |
Retention Index |
2240 |
SMILES |
OC(C1=CC=CC=C1)(C=1C=CC=CC1)C#CCN1CCCC1 |
SPLASH |
splash10-0006-3890000000-c20ff9b24a027f66820b |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1,1-Diphenyl-4-pyrrolidin-1-yl-but-2-yn-1-ol |
Technique |
GC/MS |
Wiley ID |
DD2024_000391 |