CID 58511

101564-52-7

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]+ 183.14918 139.5
[M+Na]+ 205.13112 140.6
[M-H]- 181.13462 143.7
[M+NH4]+ 200.17572 155.3
[M+K]+ 221.10506 142.8
[M+H-H2O]+ 165.13916 131.7
[M+HCOO]- 227.14010 156.8
[M+CH3COO]- 241.15575 149.7
[M+Na-2H]- 203.11657 143.3
[M]+ 182.14135 129.2
[M]- 182.14245 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.