| SpectraBase Spectrum ID |
8I2icNwpEWl |
| Name |
Barnidipine |
| CAS Registry Number |
104713-75-9 |
| Classification |
Ca Antagonist |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
491.205635660 u |
| Formula |
C27H29N3O6 |
| InChI |
InChI=1S/C27H29N3O6/c1-17-23(26(31)35-3)25(21-11-7-8-12-22(21)30(33)34)24(18(2)28-17)27(32)36-20-13-14-29(16-20)15-19-9-5-4-6-10-19/h4-12,20,25,28H,13-16H2,1-3H3 |
| InChIKey |
SXSGEQQEGMODGG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
491.544 g/mol |
| SMILES |
C=1(C(C(=C(C)NC1C)C(=O)OC)c1c(N(=O)=O)cccc1)C(OC1CN(Cc2ccccc2)CC1)=O |
| SPLASH |
splash10-0a4i-4920000000-4d5f71208962b1d3fdad |
| 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: G |
| 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_4507 |
