CID 23435

7005-47-2

Structural Information

Molecular Formula
C6H15NO
SMILES
CC(C)(CO)N(C)C
InChI
InChI=1S/C6H15NO/c1-6(2,5-8)7(3)4/h8H,5H2,1-4H3
InChIKey
XRIBIDPMFSLGFS-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

4
References

7478
Patents

117.115364 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.12264 126.0
[M+Na]+ 140.10458 132.6
[M-H]- 116.10809 126.6
[M+NH4]+ 135.14919 148.6
[M+K]+ 156.07852 133.7
[M+H-H2O]+ 100.11262 121.9
[M+HCOO]- 162.11356 148.5
[M+CH3COO]- 176.12922 175.1
[M+Na-2H]- 138.09003 132.7
[M]+ 117.11482 126.8
[M]- 117.11591 126.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe