CID 137838619

2095409-61-1

Structural Information

Molecular Formula
C8H13N
SMILES
C1CC12C(C23CC3)CN
InChI
InChI=1S/C8H13N/c9-5-6-7(1-2-7)8(6)3-4-8/h6H,1-5,9H2
InChIKey
YSEBKCHFGNUDBY-UHFFFAOYSA-N
Compound name
dispiro[2.0.24.13]heptan-7-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

123.1048 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.11208 94.1
[M+Na]+ 146.09402 104.7
[M+NH4]+ 141.13862 103.9
[M+K]+ 162.06796 104.8
[M-H]- 122.09752 110.7
[M+Na-2H]- 144.07947 108.8
[M]+ 123.10425 102.7
[M]- 123.10535 102.7
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.