CID 6420204

Dpa-713 c-11

Structural Information

Molecular Formula
C21H26N4O2
SMILES
CCN(CC)C(=O)CC1=C2N=C(C=C(N2N=C1C3=CC=C(C=C3)O[11CH3])C)C
InChI
InChI=1S/C21H26N4O2/c1-6-24(7-2)19(26)13-18-20(16-8-10-17(27-5)11-9-16)23-25-15(4)12-14(3)22-21(18)25/h8-12H,6-7,13H2,1-5H3/i5-1
InChIKey
ILZWUAWCTNWSFZ-SFIIULIVSA-N
Compound name
N,N-diethyl-2-[2-(4-(111C)methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

365.217 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.22428 189.9
[M+Na]+ 388.20622 204.1
[M+NH4]+ 383.25082 196.1
[M+K]+ 404.18016 198.8
[M-H]- 364.20972 193.2
[M+Na-2H]- 386.19167 196.2
[M]+ 365.21645 192.9
[M]- 365.21755 192.9
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

patents stripe