CID 105428296

2-{2-oxaspiro[3.3]heptan-6-yl}ethan-1-amine

Structural Information

Molecular Formula
C8H15NO
SMILES
C1C(CC12COC2)CCN
InChI
InChI=1S/C8H15NO/c9-2-1-7-3-8(4-7)5-10-6-8/h7H,1-6,9H2
InChIKey
YGFWVWMYCIVDMQ-UHFFFAOYSA-N
Compound name
2-(2-oxaspiro[3.3]heptan-6-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 121.5
[M+Na]+ 164.104588 125.0
[M-H]- 140.108094 126.9
[M+NH4]+ 159.149193 130.1
[M+K]+ 180.078528 130.8
[M+H-H2O]+ 124.112630 108.3
[M+HCOO]- 186.113571 139.9
[M+CH3COO]- 200.129221 188.4
[M+Na-2H]- 162.090036 128.8
[M]+ 141.11482142 135.6
[M]- 141.11591858 135.6
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.