CID 167722609

1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-4-amine hydrochloride

Structural Information

Molecular Formula
C10H19NO
SMILES
CC1(C2(CCC(O1)(CC2)C)N)C
InChI
InChI=1S/C10H19NO/c1-8(2)10(11)6-4-9(3,12-8)5-7-10/h4-7,11H2,1-3H3
InChIKey
RJCACOJQWVPOCU-UHFFFAOYSA-N
Compound name
1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.14667 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.153946 139.2
[M+Na]+ 192.135888 145.8
[M-H]- 168.139394 136.9
[M+NH4]+ 187.180493 168.3
[M+K]+ 208.109828 144.6
[M+H-H2O]+ 152.143930 134.7
[M+HCOO]- 214.144871 150.3
[M+CH3COO]- 228.160521 150.7
[M+Na-2H]- 190.121336 152.7
[M]+ 169.14612142 140.2
[M]- 169.14721858 140.2
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.