CID 13490010

95857-81-1

Structural Information

Molecular Formula
C11H17N3O2
SMILES
C1COC(C2=C1NC=N2)CN3CCOCC3
InChI
InChI=1S/C11H17N3O2/c1-4-16-10(11-9(1)12-8-13-11)7-14-2-5-15-6-3-14/h8,10H,1-7H2,(H,12,13)
InChIKey
FSFGAUQTHHKDLV-UHFFFAOYSA-N
Compound name
4-(morpholin-4-ylmethyl)-1,4,6,7-tetrahydropyrano[3,4-d]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.13208 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.13936 150.3
[M+Na]+ 246.12130 155.0
[M-H]- 222.12480 152.2
[M+NH4]+ 241.16590 163.1
[M+K]+ 262.09524 153.8
[M+H-H2O]+ 206.12934 141.2
[M+HCOO]- 268.13028 162.0
[M+CH3COO]- 282.14593 160.1
[M+Na-2H]- 244.10675 154.6
[M]+ 223.13153 144.8
[M]- 223.13263 144.8
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

No patent data available for this compound.