CID 54596090

3-ethoxyspiro[3.4]octan-1-amine

Structural Information

Molecular Formula
C10H19NO
SMILES
CCOC1CC(C12CCCC2)N
InChI
InChI=1S/C10H19NO/c1-2-12-9-7-8(11)10(9)5-3-4-6-10/h8-9H,2-7,11H2,1H3
InChIKey
XTYJBOSOXNCQDY-UHFFFAOYSA-N
Compound name
3-ethoxyspiro[3.4]octan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.14667 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.153946 136.4
[M+Na]+ 192.135888 141.0
[M-H]- 168.139394 141.3
[M+NH4]+ 187.180493 153.9
[M+K]+ 208.109828 142.2
[M+H-H2O]+ 152.143930 127.0
[M+HCOO]- 214.144871 157.2
[M+CH3COO]- 228.160521 183.9
[M+Na-2H]- 190.121336 139.8
[M]+ 169.14612142 141.4
[M]- 169.14721858 141.4
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.