CID 66649330

6-(aminomethyl)spiro[2.5]octan-6-ol hydrochloride

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC12CCC(CC2)(CN)O
InChI
InChI=1S/C9H17NO/c10-7-9(11)5-3-8(1-2-8)4-6-9/h11H,1-7,10H2
InChIKey
RFXFHPIUKJZORB-UHFFFAOYSA-N
Compound name
6-(aminomethyl)spiro[2.5]octan-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

155.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 136.7
[M+Na]+ 178.12023 147.6
[M+NH4]+ 173.16483 149.0
[M+K]+ 194.09417 139.9
[M-H]- 154.12373 146.6
[M+Na-2H]- 176.10568 147.0
[M]+ 155.13046 142.4
[M]- 155.13156 142.4
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