CID 21135

Dtxsid20964716

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CCC(CC1)O[C@H]2C[C@@H]2N
InChI
InChI=1S/C9H17NO/c10-8-6-9(8)11-7-4-2-1-3-5-7/h7-9H,1-6,10H2/t8-,9-/m0/s1
InChIKey
KETZJZOIAONYOS-IUCAKERBSA-N
Compound name
trans-(1S,2S)-2-cyclohexyloxycyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.138286 132.3
[M+Na]+ 178.120228 138.8
[M-H]- 154.123734 138.8
[M+NH4]+ 173.164833 147.9
[M+K]+ 194.094168 136.8
[M+H-H2O]+ 138.128270 125.9
[M+HCOO]- 200.129211 153.7
[M+CH3COO]- 214.144861 181.7
[M+Na-2H]- 176.105676 136.9
[M]+ 155.13046142 129.5
[M]- 155.13155858 129.5
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.