| SpectraBase Spectrum ID |
H2LY1L0nS71 |
| Name |
Paromomycin |
| CAS Registry Number |
7542-37-2 |
| Collision Energy |
40 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
615.296301135 u |
| Formula |
C23H45N5O14 |
| InChI |
InChI=1S/C23H45N5O14/c24-2-7-13(32)15(34)10(27)21(37-7)41-19-9(4-30)39-23(17(19)36)42-20-12(31)5(25)1-6(26)18(20)40-22-11(28)16(35)14(33)8(3-29)38-22/h5-23,29-36H,1-4,24-28H2/t5-,6+,7+,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1 |
| InChIKey |
UOZODPSAJZTQNH-LSWIJEOBSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
615.634 g/mol |
| Nominal Mass |
615 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
616.304 |
| SMILES |
O[C@@]1([C@](O[C@](O[C@]2([C@@]([C@@](O)([C@@](C[C@@]2(N)[H])(N)[H])[H])(O[C@@]2(O[C@@]([C@@](O[C@]3(O[C@]([C@@](O)([C@](O)([C@]3(N)[H])[H])[H])(CN)[H])[H])([C@]2(O)[H])[H])(CO)[H])[H])[H])[H])([C@@]([C@]1(O)[H])(N)[H])[H])(CO)[H])[H] |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
(2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-[(2R,3S,4R,5S)-5-[(1R,2R,3S,5R,6S)-3,5-diamino-2-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxyoxane-3,4-diol |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_704.7 |
