CID 295957

7539-61-9

Structural Information

Molecular Formula
C9H21NO
SMILES
CC(C)N(CCCO)C(C)C
InChI
InChI=1S/C9H21NO/c1-8(2)10(9(3)4)6-5-7-11/h8-9,11H,5-7H2,1-4H3
InChIKey
OWPYHAWCSDPFTR-UHFFFAOYSA-N
Compound name
3-[di(propan-2-yl)amino]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

295
Patents

159.16231 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.169586 141.5
[M+Na]+ 182.151528 145.9
[M-H]- 158.155034 141.4
[M+NH4]+ 177.196133 162.1
[M+K]+ 198.125468 146.7
[M+H-H2O]+ 142.159570 136.2
[M+HCOO]- 204.160511 162.5
[M+CH3COO]- 218.176161 185.7
[M+Na-2H]- 180.136976 143.2
[M]+ 159.16176142 142.5
[M]- 159.16285858 142.5
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