CID 58511

Cycloheptylamine, n-(2-oxazolinyl)-

Structural Information

Molecular Formula
C10H18N2O
SMILES
C1CCCC(CC1)NC2NC=CO2
InChI
InChI=1S/C10H18N2O/c1-2-4-6-9(5-3-1)12-10-11-7-8-13-10/h7-12H,1-6H2
InChIKey
UBJGQEKROPNNPE-UHFFFAOYSA-N
Compound name
N-cycloheptyl-2,3-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.1419 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.149176 139.5
[M+Na]+ 205.131118 140.6
[M-H]- 181.134624 143.7
[M+NH4]+ 200.175723 155.3
[M+K]+ 221.105058 142.8
[M+H-H2O]+ 165.139160 131.7
[M+HCOO]- 227.140101 156.8
[M+CH3COO]- 241.155751 149.7
[M+Na-2H]- 203.116566 143.3
[M]+ 182.14135142 129.2
[M]- 182.14244858 129.2
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.