CID 53534947

2-methyl-1-[(oxan-4-yl)amino]propan-2-ol

Structural Information

Molecular Formula
C9H19NO2
SMILES
CC(C)(CNC1CCOCC1)O
InChI
InChI=1S/C9H19NO2/c1-9(2,11)7-10-8-3-5-12-6-4-8/h8,10-11H,3-7H2,1-2H3
InChIKey
JRCNNLWYWYAKEO-UHFFFAOYSA-N
Compound name
2-methyl-1-(oxan-4-ylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

173.14159 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.14887 140.1
[M+Na]+ 196.13081 143.6
[M-H]- 172.13431 142.0
[M+NH4]+ 191.17541 157.9
[M+K]+ 212.10475 143.7
[M+H-H2O]+ 156.13885 134.7
[M+HCOO]- 218.13979 157.8
[M+CH3COO]- 232.15544 179.0
[M+Na-2H]- 194.11626 146.9
[M]+ 173.14104 136.1
[M]- 173.14214 136.1
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

patents stripe