| SpectraBase Compound ID | CvPUn0F7paW |
|---|---|
| InChI | InChI=1S/2C17H23NO3.H2O4S.H2O/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4;/h2*2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4);1H2/t2*13-,14+,15-,16?;; |
| InChIKey | JPKKQJKQTPNWTR-OFGCMVCXSA-N |
| Mol Weight | 692.82 g/mol |
| Molecular Formula | C34H48N2O11S |
| Exact Mass | 692.297882 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | KGNJRzoNxPd |
|---|---|
| Name | Atropine sulfate salt monohydrate |
| Source of Sample | Aldrich |
| Catalog Number | 852996 |
| CAS Registry Number | 5908-99-6 |
| Copyright | Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H48N2O10S*H2O |
| InChI | InChI=1S/2C17H23NO3.H2O4S.H2O/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4;/h2*2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4);1H2/t2*13-,14+,15-,16?;; |
| InChIKey | JPKKQJKQTPNWTR-OFGCMVCXSA-N |
| Purity | 98% |
| Synonyms | alpha-(Hydroxymethyl)benzeneacetic acid 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester Tropine tropate |
| Wiley ID | SIAL_ATR-IR_021974 |