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]+ 156.138286 134.2
[M+Na]+ 178.120228 137.7
[M-H]- 154.123734 138.0
[M+NH4]+ 173.164833 144.4
[M+K]+ 194.094168 141.2
[M+H-H2O]+ 138.128270 122.2
[M+HCOO]- 200.129211 151.4
[M+CH3COO]- 214.144861 188.6
[M+Na-2H]- 176.105676 139.8
[M]+ 155.13046142 146.6
[M]- 155.13155858 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.