CID 109895251

2241145-49-1

Structural Information

Molecular Formula
C16H27N3O
SMILES
C1COCCN1C(=NCC2C3CC4CC(C3)CC2C4)N
InChI
InChI=1S/C16H27N3O/c17-16(19-1-3-20-4-2-19)18-10-15-13-6-11-5-12(8-13)9-14(15)7-11/h11-15H,1-10H2,(H2,17,18)
InChIKey
XUIFMLIMGISPBC-UHFFFAOYSA-N
Compound name
N'-(2-adamantylmethyl)morpholine-4-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.21542 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.22270 163.8
[M+Na]+ 300.20464 170.9
[M+NH4]+ 295.24924 174.3
[M+K]+ 316.17858 163.9
[M-H]- 276.20814 165.3
[M+Na-2H]- 298.19009 159.0
[M]+ 277.21487 164.9
[M]- 277.21597 164.9
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.