CID 91825907

6-(aminomethyl)spiro[3.3]heptan-2-ol hydrochloride

Structural Information

Molecular Formula
C8H15NO
SMILES
C1C(CC12CC(C2)O)CN
InChI
InChI=1S/C8H15NO/c9-5-6-1-8(2-6)3-7(10)4-8/h6-7,10H,1-5,9H2
InChIKey
BGYRPUGBZRCIOG-UHFFFAOYSA-N
Compound name
6-(aminomethyl)spiro[3.3]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 127.0
[M+Na]+ 164.104588 130.8
[M-H]- 140.108094 130.8
[M+NH4]+ 159.149193 136.2
[M+K]+ 180.078528 134.7
[M+H-H2O]+ 124.112630 113.9
[M+HCOO]- 186.113571 144.5
[M+CH3COO]- 200.129221 187.2
[M+Na-2H]- 162.090036 131.8
[M]+ 141.11482142 139.1
[M]- 141.11591858 139.1
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.