| SpectraBase Spectrum ID |
KdyZDKJGEIa |
| Name |
Ambroxol-M (HO-) 4AC |
| Classification |
Expectorant |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
560.015762559 u |
| Formula |
C21H26Br2N2O6 |
| InChI |
InChI=1S/C21H26Br2N2O6/c1-11(26)24-21-15(7-16(22)8-18(21)23)10-25(12(2)27)17-5-6-19(30-13(3)28)20(9-17)31-14(4)29/h7-8,17,19-20H,5-6,9-10H2,1-4H3,(H,24,26) |
| InChIKey |
AJLGGSBYCOAPIO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
562.255 g/mol |
| SMILES |
c1(c(c(Br)cc(c1)Br)NC(=O)C)CN(C1CC(C(OC(=O)C)CC1)OC(=O)C)C(=O)C |
| SPLASH |
splash10-0o6r-3279230000-f10d980184fcb4e4c5bf |
| 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: U+UHYAC |
| 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_4446 |
