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

4
Patents

132.13884 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.146116 125.8
[M+Na]+ 155.128058 132.9
[M-H]- 131.131564 127.0
[M+NH4]+ 150.172663 148.1
[M+K]+ 171.101998 128.0
[M+H-H2O]+ 115.136100 125.4
[M+HCOO]- 177.137041 147.2
[M+CH3COO]- 191.152691 171.1
[M+Na-2H]- 153.113506 136.9
[M]+ 132.13829142 125.5
[M]- 132.13938858 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