CID 19431211

1-(dimethylamino)-3-methylpentan-2-ol

Structural Information

Molecular Formula
C8H19NO
SMILES
CCC(C)C(CN(C)C)O
InChI
InChI=1S/C8H19NO/c1-5-7(2)8(10)6-9(3)4/h7-8,10H,5-6H2,1-4H3
InChIKey
UDMYNGFHCVMASR-UHFFFAOYSA-N
Compound name
1-(dimethylamino)-3-methylpentan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

145.14667 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.153946 136.8
[M+Na]+ 168.135888 141.6
[M-H]- 144.139394 136.9
[M+NH4]+ 163.180493 158.0
[M+K]+ 184.109828 142.7
[M+H-H2O]+ 128.143930 131.7
[M+HCOO]- 190.144871 158.1
[M+CH3COO]- 204.160521 182.6
[M+Na-2H]- 166.121336 139.1
[M]+ 145.14612142 137.4
[M]- 145.14721858 137.4
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