CID 138040587

2168460-25-9

Structural Information

Molecular Formula
C9H17N
SMILES
C1CC2(C1)CC(C2)CCN
InChI
InChI=1S/C9H17N/c10-5-2-8-6-9(7-8)3-1-4-9/h8H,1-7,10H2
InChIKey
YXGZDABODVIKQC-UHFFFAOYSA-N
Compound name
2-spiro[3.3]heptan-2-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.1361 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.14338 126.4
[M+Na]+ 162.12532 129.9
[M-H]- 138.12882 131.2
[M+NH4]+ 157.16992 136.3
[M+K]+ 178.09926 133.8
[M+H-H2O]+ 122.13336 113.2
[M+HCOO]- 184.13430 145.1
[M+CH3COO]- 198.14995 189.4
[M+Na-2H]- 160.11077 132.1
[M]+ 139.13555 139.0
[M]- 139.13665 139.0
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.