CID 476767

Dam-ddc

Structural Information

Molecular Formula
C12H18N4O3
SMILES
CN(C)C=NC1=NC(=O)N(C=C1)[C@H]2CC[C@H](O2)CO
InChI
InChI=1S/C12H18N4O3/c1-15(2)8-13-10-5-6-16(12(18)14-10)11-4-3-9(7-17)19-11/h5-6,8-9,11,17H,3-4,7H2,1-2H3/t9-,11+/m0/s1
InChIKey
ZSDHJVYNLVMDBK-GXSJLCMTSA-N
Compound name
N'-[1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

266.13788 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.14516 160.1
[M+Na]+ 289.12710 167.0
[M-H]- 265.13060 166.4
[M+NH4]+ 284.17170 174.5
[M+K]+ 305.10104 166.5
[M+H-H2O]+ 249.13514 151.1
[M+HCOO]- 311.13608 183.0
[M+CH3COO]- 325.15173 202.9
[M+Na-2H]- 287.11255 163.5
[M]+ 266.13733 161.8
[M]- 266.13843 161.8
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