CID 92487

56669-92-2

Structural Information

Molecular Formula
C22H47NO
SMILES
CCCCCCCCCCCCCCCCCCN(C)CC(C)O
InChI
InChI=1S/C22H47NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(3)21-22(2)24/h22,24H,4-21H2,1-3H3
InChIKey
FIIVRQMXFMRFJI-UHFFFAOYSA-N
Compound name
1-[methyl(octadecyl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

341.36575 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.37303 200.2
[M+Na]+ 364.35497 199.4
[M-H]- 340.35847 197.5
[M+NH4]+ 359.39957 213.5
[M+K]+ 380.32891 196.3
[M+H-H2O]+ 324.36301 192.3
[M+HCOO]- 386.36395 217.9
[M+CH3COO]- 400.37960 223.6
[M+Na-2H]- 362.34042 196.3
[M]+ 341.36520 206.9
[M]- 341.36630 206.9
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

patents stripe