CID 167718151

2-(2,2,6,6-tetramethyloxan-4-yl)ethan-1-amine

Structural Information

Molecular Formula
C11H23NO
SMILES
CC1(CC(CC(O1)(C)C)CCN)C
InChI
InChI=1S/C11H23NO/c1-10(2)7-9(5-6-12)8-11(3,4)13-10/h9H,5-8,12H2,1-4H3
InChIKey
OFRQBDMBQHPJHQ-UHFFFAOYSA-N
Compound name
2-(2,2,6,6-tetramethyloxan-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.17796 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.18524 142.3
[M+Na]+ 208.16718 148.8
[M-H]- 184.17068 146.0
[M+NH4]+ 203.21178 164.8
[M+K]+ 224.14112 148.7
[M+H-H2O]+ 168.17522 138.4
[M+HCOO]- 230.17616 161.5
[M+CH3COO]- 244.19181 186.2
[M+Na-2H]- 206.15263 147.9
[M]+ 185.17741 140.5
[M]- 185.17851 140.5
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

No patent data available for this compound.