CID 237041

2893-48-3

Structural Information

Molecular Formula
C7H17NO
SMILES
CCCCN(C)CCO
InChI
InChI=1S/C7H17NO/c1-3-4-5-8(2)6-7-9/h9H,3-7H2,1-2H3
InChIKey
YSNMZQFDMNKNFQ-UHFFFAOYSA-N
Compound name
2-[butyl(methyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

336
Patents

131.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.13829 129.9
[M+Na]+ 154.12023 139.1
[M+NH4]+ 149.16483 137.9
[M+K]+ 170.09417 133.7
[M-H]- 130.12373 130.0
[M+Na-2H]- 152.10568 133.6
[M]+ 131.13046 131.0
[M]- 131.13156 131.0
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