CID 43608790

3-(pyrrolidin-1-yl)oxan-4-amine dihydrochloride

Structural Information

Molecular Formula
C9H18N2O
SMILES
C1CCN(C1)C2COCCC2N
InChI
InChI=1S/C9H18N2O/c10-8-3-6-12-7-9(8)11-4-1-2-5-11/h8-9H,1-7,10H2
InChIKey
RFMIKYYMIRHJKS-UHFFFAOYSA-N
Compound name
3-pyrrolidin-1-yloxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.1419 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.14918 139.1
[M+Na]+ 193.13112 142.7
[M-H]- 169.13462 143.3
[M+NH4]+ 188.17572 157.6
[M+K]+ 209.10506 142.2
[M+H-H2O]+ 153.13916 131.8
[M+HCOO]- 215.14010 157.0
[M+CH3COO]- 229.15575 178.6
[M+Na-2H]- 191.11657 141.7
[M]+ 170.14135 131.2
[M]- 170.14245 131.2
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.