CID 9836345

N-(4-methoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)-1h-indazol-6-amine

Structural Information

Molecular Formula
C15H17N7O
SMILES
COC1=NC(=NC(=N1)N2CCCC2)NC3=CC4=C(C=C3)C=NN4
InChI
InChI=1S/C15H17N7O/c1-23-15-19-13(18-14(20-15)22-6-2-3-7-22)17-11-5-4-10-9-16-21-12(10)8-11/h4-5,8-9H,2-3,6-7H2,1H3,(H,16,21)(H,17,18,19,20)
InChIKey
WXQGLRWGKLVSBW-UHFFFAOYSA-N
Compound name
N-(4-methoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)-1H-indazol-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.14944 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.15672 169.2
[M+Na]+ 334.13866 178.0
[M-H]- 310.14216 172.0
[M+NH4]+ 329.18326 178.9
[M+K]+ 350.11260 171.8
[M+H-H2O]+ 294.14670 157.5
[M+HCOO]- 356.14764 186.1
[M+CH3COO]- 370.16329 178.6
[M+Na-2H]- 332.12411 172.9
[M]+ 311.14889 168.4
[M]- 311.14999 168.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.