SpectraBase Spectrum ID |
BDcaYVk0zmV |
Name |
Gallopamil |
CAS Registry Number |
16662-47-8 |
Collision Energy |
25 eV |
Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
Exact Mass |
484.293722391 u |
Formula |
C28H40N2O5 |
InChI |
InChI=1S/C28H40N2O5/c1-20(2)28(19-29,22-17-25(33-6)27(35-8)26(18-22)34-7)13-9-14-30(3)15-12-21-10-11-23(31-4)24(16-21)32-5/h10-11,16-18,20H,9,12-15H2,1-8H3 |
InChIKey |
XQLWNAFCTODIRK-UHFFFAOYSA-N |
Instrument Name |
QStar XL, AB Sciex |
Ion Polarity |
P |
Ionization Type |
ESI+ |
Molecular Weight |
484.637 g/mol |
Nominal Mass |
484 u |
Precursor Ion |
[M+H]+ |
Precursor m/z |
485.301 |
SMILES |
C1(OC)=CC(C(C(C)C)(CCCN(CCC2=CC(OC)=C(OC)C=C2)C)C#N)=CC(OC)=C1OC |
Selected Ion Charge |
1 |
Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
Spectrum Type |
ms2 |
Synonyms |
5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile |
Technique |
Q-TOF |
Wiley ID |
MSforID_+_383.4 |