CID 21135

Trans-(+-)-2-cyclohexyloxycyclopropylamine

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
(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]+ 156.13829 132.3
[M+Na]+ 178.12023 138.8
[M-H]- 154.12373 138.8
[M+NH4]+ 173.16483 147.9
[M+K]+ 194.09417 136.8
[M+H-H2O]+ 138.12827 125.9
[M+HCOO]- 200.12921 153.7
[M+CH3COO]- 214.14486 181.7
[M+Na-2H]- 176.10568 136.9
[M]+ 155.13046 129.5
[M]- 155.13156 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.