CID 205025

17199-19-8

Structural Information

Molecular Formula
C7H18NO
SMILES
CC(C)(CO)[N+](C)(C)C
InChI
InChI=1S/C7H18NO/c1-7(2,6-9)8(3,4)5/h9H,6H2,1-5H3/q+1
InChIKey
ROYKZFRTYJMWFE-UHFFFAOYSA-N
Compound name
(1-hydroxy-2-methylpropan-2-yl)-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

132.13884 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.14612 125.8
[M+Na]+ 155.12806 132.9
[M-H]- 131.13156 127.0
[M+NH4]+ 150.17266 148.1
[M+K]+ 171.10200 128.0
[M+H-H2O]+ 115.13610 125.4
[M+HCOO]- 177.13704 147.2
[M+CH3COO]- 191.15269 171.1
[M+Na-2H]- 153.11351 136.9
[M]+ 132.13829 125.5
[M]- 132.13939 125.5
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