CID 65009546

[2-(aminomethyl)spiro[3.3]heptan-2-yl]methanol

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC2(C1)CC(C2)(CN)CO
InChI
InChI=1S/C9H17NO/c10-6-9(7-11)4-8(5-9)2-1-3-8/h11H,1-7,10H2
InChIKey
PRPSGKZXWAYDFX-UHFFFAOYSA-N
Compound name
[2-(aminomethyl)spiro[3.3]heptan-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 134.2
[M+Na]+ 178.12023 137.7
[M-H]- 154.12373 138.0
[M+NH4]+ 173.16483 144.4
[M+K]+ 194.09417 141.2
[M+H-H2O]+ 138.12827 122.2
[M+HCOO]- 200.12921 151.4
[M+CH3COO]- 214.14486 188.6
[M+Na-2H]- 176.10568 139.8
[M]+ 155.13046 146.6
[M]- 155.13156 146.6
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.