CID 146081979

2408968-92-1

Structural Information

Molecular Formula
C8H15NO2
SMILES
C1COC2(CC1(C2)CO)CN
InChI
InChI=1S/C8H15NO2/c9-5-8-3-7(4-8,6-10)1-2-11-8/h10H,1-6,9H2
InChIKey
LFJUUJYCUSTHFF-UHFFFAOYSA-N
Compound name
[1-(aminomethyl)-2-oxabicyclo[3.1.1]heptan-5-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

157.11028 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 143.1
[M+Na]+ 180.099498 147.7
[M-H]- 156.103004 141.3
[M+NH4]+ 175.144103 162.9
[M+K]+ 196.073438 149.9
[M+H-H2O]+ 140.107540 135.1
[M+HCOO]- 202.108481 155.2
[M+CH3COO]- 216.124131 182.1
[M+Na-2H]- 178.084946 155.4
[M]+ 157.10973142 152.8
[M]- 157.11082858 152.8
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.