| SpectraBase Spectrum ID |
KrG6dao6Um |
| Name |
Atenolol n-butylboronate |
| Alternate Name(s) |
2-[4-[(2-butyl-3-propan-2-yl-1,3,2-oxazaborolidin-5-yl)methoxy]phenyl]acetamide
2-[4-[(2-butyl-3-propan-2-yl-1,3,2-oxazaborolidin-5-yl)methoxy]phenyl]ethanamide |
| CAS Registry Number |
127202-14-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H29BN2O3 |
| InChI |
InChI=1S/C18H29BN2O3/c1-4-5-10-19-21(14(2)3)12-17(24-19)13-23-16-8-6-15(7-9-16)11-18(20)22/h6-9,14,17H,4-5,10-13H2,1-3H3,(H2,20,22) |
| InChIKey |
DCAZCPGJKMQVIK-UHFFFAOYSA-N |
| Molecular Weight |
332.251 g/mol |
| SMILES |
NC(Cc1ccc(OCC2OB(N(C2)C(C)C)CCCC)cc1)=O |
| SPLASH |
splash10-014i-0009000000-d1f397324a299def3a65 |
| Source of Spectrum |
JC-488-364-0 |
| Wiley ID |
1329416 |
