Spectrum PR020103 for Dihydrozeatin riboside

Rating: (*)(*)(*)(*)(*)

Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
InChI=1S/C15H23N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h6-9,11-12,15,21-24H,2-5H2,1H3,(H,16,17,18)/t8?,9-,11-,12-,15-/m1/s1
DBVVQDGIJAUEAZ-YXYADJKSSA-N
C15H23N5O5
353.169918836
OCC1OC(N2C=NC=3C(=NC=NC32)NCCC(C)CO)C(O)C1O

Mass Spectral Metadata

NameValue
PR020103
2016.01.19 (Created 2007.12.03, modified 2011.05.06)
Kojima M, Sakakibara H, Plant Science Center, RIKEN.
CC BY-SA
353.16992
UPLC Waters, Quattro Ultima Pt Micromass
LC-ESI-QQ
MS2
20.0 eV
Centroid
565 L/Hr
400 C
LOW-ENERGY CID
ESI
0.2 sec/scan (m/z=50-500)
140 C
3.1 kV
ACQUITY UPLC BEH C18 2.1 by 50 mm (Waters, Milford, MA, USA)
40 C
0.1/99.9 at 0 min, 9.0/91.0 at 2 min, 12.5/87.5 at 7 min, 30/70 at 10 min, 50/50 at 12 min, 50/50 at 13 min, 99.9/0.1 at 15 min
0.25 ml/min
10.13 min
53 V
CH3CN(0.05% HCOOH) / HCOOH(0.05% CH3CN)
353
MassLynx 4.0
positive
0.3672342713045845
0.2649035310277981
354
[M+H]+
502.51083615825524 ppm
-0.17788883600002237 Da