CID 20055495

Meprochol

Structural Information

Molecular Formula
C7H16NO
SMILES
C[N+](C)(C)CC(=C)OC
InChI
InChI=1S/C7H16NO/c1-7(9-5)6-8(2,3)4/h1,6H2,2-5H3/q+1
InChIKey
VWUPRJOOPQHUJN-UHFFFAOYSA-N
Compound name
2-methoxyprop-2-enyl(trimethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

22
Patents

130.12318 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.13046 126.5
[M+Na]+ 153.11240 138.5
[M+NH4]+ 148.15700 135.9
[M+K]+ 169.08634 134.1
[M-H]- 129.11590 128.3
[M+Na-2H]- 151.09785 132.0
[M]+ 130.12263 129.0
[M]- 130.12373 129.0
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