CID 334347

2-[[4-(dimethylamino)pyrrolo[2,3-d]pyrimidin-7-yl]methoxy]ethanol

Structural Information

Molecular Formula
C11H16N4O2
SMILES
CN(C)C1=NC=NC2=C1C=CN2COCCO
InChI
InChI=1S/C11H16N4O2/c1-14(2)10-9-3-4-15(8-17-6-5-16)11(9)13-7-12-10/h3-4,7,16H,5-6,8H2,1-2H3
InChIKey
UOIWXJLFXNFYDU-UHFFFAOYSA-N
Compound name
2-[[4-(dimethylamino)pyrrolo[2,3-d]pyrimidin-7-yl]methoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

236.12732 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.13460 151.6
[M+Na]+ 259.11654 161.1
[M-H]- 235.12004 152.9
[M+NH4]+ 254.16114 168.3
[M+K]+ 275.09048 158.9
[M+H-H2O]+ 219.12458 143.1
[M+HCOO]- 281.12552 174.1
[M+CH3COO]- 295.14117 194.7
[M+Na-2H]- 257.10199 158.3
[M]+ 236.12677 157.1
[M]- 236.12787 157.1
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.