CID 106429

51410-72-1

Structural Information

Molecular Formula
C10H21N2O
SMILES
CC(=C)C(=O)NCCC[N+](C)(C)C
InChI
InChI=1S/C10H20N2O/c1-9(2)10(13)11-7-6-8-12(3,4)5/h1,6-8H2,2-5H3/p+1
InChIKey
VZTGWJFIMGVKSN-UHFFFAOYSA-O
Compound name
trimethyl-[3-(2-methylprop-2-enoylamino)propyl]azanium
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

16
References

24956
Patents

185.16539 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.17267 141.5
[M+Na]+ 208.15461 146.5
[M-H]- 184.15811 143.3
[M+NH4]+ 203.19921 161.7
[M+K]+ 224.12855 141.0
[M+H-H2O]+ 168.16265 139.3
[M+HCOO]- 230.16359 164.4
[M+CH3COO]- 244.17924 185.8
[M+Na-2H]- 206.14006 148.3
[M]+ 185.16484 141.0
[M]- 185.16594 141.0
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