CID 94558177

Rac-[(1r,2s)-2-(oxan-4-yl)cyclopropyl]methanamine hydrochloride

Structural Information

Molecular Formula
C9H17NO
SMILES
C1COCCC1[C@@H]2C[C@H]2CN
InChI
InChI=1S/C9H17NO/c10-6-8-5-9(8)7-1-3-11-4-2-7/h7-9H,1-6,10H2/t8-,9-/m0/s1
InChIKey
AXSNFTMZHHKYGS-IUCAKERBSA-N
Compound name
[(1R,2S)-2-(oxan-4-yl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 132.7
[M+Na]+ 178.12023 139.3
[M-H]- 154.12373 139.9
[M+NH4]+ 173.16483 147.2
[M+K]+ 194.09417 138.4
[M+H-H2O]+ 138.12827 126.1
[M+HCOO]- 200.12921 153.1
[M+CH3COO]- 214.14486 181.6
[M+Na-2H]- 176.10568 138.3
[M]+ 155.13046 130.6
[M]- 155.13156 130.6
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.