CID 136408

2-(diethylamino)propan-1-ol

Structural Information

Molecular Formula
C7H17NO
SMILES
CCN(CC)C(C)CO
InChI
InChI=1S/C7H17NO/c1-4-8(5-2)7(3)6-9/h7,9H,4-6H2,1-3H3
InChIKey
FBJITINXSJWUMT-UHFFFAOYSA-N
Compound name
2-(diethylamino)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

240
Patents

131.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.13829 130.4
[M+Na]+ 154.12023 139.3
[M+NH4]+ 149.16483 138.3
[M+K]+ 170.09417 134.6
[M-H]- 130.12373 130.3
[M+Na-2H]- 152.10568 133.7
[M]+ 131.13046 131.3
[M]- 131.13156 131.3
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