CID 118693024

{spiro[2.5]octan-5-yl}methanamine hydrochloride

Structural Information

Molecular Formula
C9H17N
SMILES
C1CC(CC2(C1)CC2)CN
InChI
InChI=1S/C9H17N/c10-7-8-2-1-3-9(6-8)4-5-9/h8H,1-7,10H2
InChIKey
CHBCKTJIEQBTOW-UHFFFAOYSA-N
Compound name
spiro[2.5]octan-7-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

139.1361 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.14338 130.8
[M+Na]+ 162.12532 137.7
[M-H]- 138.12882 136.4
[M+NH4]+ 157.16992 149.2
[M+K]+ 178.09926 136.1
[M+H-H2O]+ 122.13336 125.5
[M+HCOO]- 184.13430 151.5
[M+CH3COO]- 198.14995 178.5
[M+Na-2H]- 160.11077 137.4
[M]+ 139.13555 127.2
[M]- 139.13665 127.2
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

patents stripe