CID 155970408

2639448-68-1

Structural Information

Molecular Formula
C8H15NO
SMILES
COCC(C12CC(C1)C2)N
InChI
InChI=1S/C8H15NO/c1-10-5-7(9)8-2-6(3-8)4-8/h6-7H,2-5,9H2,1H3
InChIKey
UUBQFNWSTBBPSP-UHFFFAOYSA-N
Compound name
1-(1-bicyclo[1.1.1]pentanyl)-2-methoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 150.2
[M+Na]+ 164.104588 152.4
[M-H]- 140.108094 152.6
[M+NH4]+ 159.149193 155.4
[M+K]+ 180.078528 159.2
[M+H-H2O]+ 124.112630 135.5
[M+HCOO]- 186.113571 163.0
[M+CH3COO]- 200.129221 207.0
[M+Na-2H]- 162.090036 155.0
[M]+ 141.11482142 173.7
[M]- 141.11591858 173.7
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.