CID 83635351

4,4-dimethyl-1-(methylamino)pentan-3-ol

Structural Information

Molecular Formula
C8H19NO
SMILES
CC(C)(C)C(CCNC)O
InChI
InChI=1S/C8H19NO/c1-8(2,3)7(10)5-6-9-4/h7,9-10H,5-6H2,1-4H3
InChIKey
LPILLGPESXNRKF-UHFFFAOYSA-N
Compound name
4,4-dimethyl-1-(methylamino)pentan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 136.3
[M+Na]+ 168.135888 141.8
[M-H]- 144.139394 135.2
[M+NH4]+ 163.180493 157.2
[M+K]+ 184.109828 141.4
[M+H-H2O]+ 128.143930 132.1
[M+HCOO]- 190.144871 156.7
[M+CH3COO]- 204.160521 177.8
[M+Na-2H]- 166.121336 141.4
[M]+ 145.14612142 135.9
[M]- 145.14721858 135.9
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.