CID 57790295

1417568-40-1

Structural Information

Molecular Formula
C8H15NO
SMILES
C1COCCC1C2(CC2)N
InChI
InChI=1S/C8H15NO/c9-8(3-4-8)7-1-5-10-6-2-7/h7H,1-6,9H2
InChIKey
FXUQQEAOOMSXHG-UHFFFAOYSA-N
Compound name
1-(oxan-4-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

141.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 129.4
[M+Na]+ 164.10459 136.2
[M-H]- 140.10809 136.8
[M+NH4]+ 159.14919 145.9
[M+K]+ 180.07853 136.6
[M+H-H2O]+ 124.11263 123.8
[M+HCOO]- 186.11357 149.7
[M+CH3COO]- 200.12922 177.2
[M+Na-2H]- 162.09004 137.0
[M]+ 141.11482 126.9
[M]- 141.11592 126.9
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

patents stripe