| SpectraBase Compound ID | JQbruhLzs1J |
|---|---|
| InChI | InChI=1S/C16H18N2O5S/c1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1 |
| InChIKey | BPLBGHOLXOTWMN-MBNYWOFBSA-N |
| Mol Weight | 350.39 g/mol |
| Molecular Formula | C16H18N2O5S |
| Exact Mass | 350.093643 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BRIIOaczi4N |
|---|---|
| Name | Penicillin V |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H18N2O5S |
| InChI | InChI=1S/C16H18N2O5S/c1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1 |
| InChIKey | BPLBGHOLXOTWMN-MBNYWOFBSA-N |
| Instrument Name | VG-7035 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/rcm.1290061110 |
| Molecular Weight | 350.389 g/mol |
| SMILES | N(C(COc1ccccc1)=O)[C@]1([C@@]2(N([C@@](C(=O)O)(C(S2)(C)C)[H])C1=O)[H])[H] |
| SPLASH | splash10-08fr-0910000000-6d320de8d9232510783c |
| Source of Spectrum | RCM-6-682-13 |
| Wiley ID | 1838777 |