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]+ 140.143376 126.4
[M+Na]+ 162.125318 129.9
[M-H]- 138.128824 131.2
[M+NH4]+ 157.169923 136.3
[M+K]+ 178.099258 133.8
[M+H-H2O]+ 122.133360 113.2
[M+HCOO]- 184.134301 145.1
[M+CH3COO]- 198.149951 189.4
[M+Na-2H]- 160.110766 132.1
[M]+ 139.13555142 139.0
[M]- 139.13664858 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.