CID 105430374

2241140-86-1

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC2CC1CC2(CN)CO
InChI
InChI=1S/C9H17NO/c10-5-9(6-11)4-7-1-2-8(9)3-7/h7-8,11H,1-6,10H2
InChIKey
BUBOKFNEOPKUKI-UHFFFAOYSA-N
Compound name
[2-(aminomethyl)-2-bicyclo[2.2.1]heptanyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 135.8
[M+Na]+ 178.12023 142.4
[M-H]- 154.12373 136.7
[M+NH4]+ 173.16483 162.8
[M+K]+ 194.09417 139.6
[M+H-H2O]+ 138.12827 132.2
[M+HCOO]- 200.12921 156.2
[M+CH3COO]- 214.14486 175.8
[M+Na-2H]- 176.10568 139.8
[M]+ 155.13046 132.1
[M]- 155.13156 132.1
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.