CID 40310

52303-77-2

Structural Information

Molecular Formula
C8H18NO
SMILES
C[N+](C)(C)CC1CCCO1
InChI
InChI=1S/C8H18NO/c1-9(2,3)7-8-5-4-6-10-8/h8H,4-7H2,1-3H3/q+1
InChIKey
NHVTWSTVVZJSLJ-UHFFFAOYSA-N
Compound name
trimethyl(oxolan-2-ylmethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

144.13884 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.146116 129.5
[M+Na]+ 167.128058 135.2
[M-H]- 143.131564 134.9
[M+NH4]+ 162.172663 151.9
[M+K]+ 183.101998 131.3
[M+H-H2O]+ 127.136100 127.6
[M+HCOO]- 189.137041 152.1
[M+CH3COO]- 203.152691 172.5
[M+Na-2H]- 165.113506 139.2
[M]+ 144.13829142 127.8
[M]- 144.13938858 127.8
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

No patent data available for this compound.