CID 177788366

1-{6-oxaspiro[2.5]octan-5-yl}methanamine hydrochloride

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CC12CCOC(C2)CN
InChI
InChI=1S/C8H15NO/c9-6-7-5-8(1-2-8)3-4-10-7/h7H,1-6,9H2
InChIKey
DXEYSTPVLARJCR-UHFFFAOYSA-N
Compound name
6-oxaspiro[2.5]octan-7-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 130.0
[M+Na]+ 164.104588 137.5
[M-H]- 140.108094 136.6
[M+NH4]+ 159.149193 147.2
[M+K]+ 180.078528 137.6
[M+H-H2O]+ 124.112630 124.6
[M+HCOO]- 186.113571 150.2
[M+CH3COO]- 200.129221 177.5
[M+Na-2H]- 162.090036 138.1
[M]+ 141.11482142 128.2
[M]- 141.11591858 128.2
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.