CID 89432922

1909288-57-8

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)[C@@H]1CCO[C@@H]1CN
InChI
InChI=1S/C8H17NO/c1-6(2)7-3-4-10-8(7)5-9/h6-8H,3-5,9H2,1-2H3/t7-,8+/m0/s1
InChIKey
ZJDSZAXRGSXRBA-JGVFFNPUSA-N
Compound name
[(2S,3S)-3-propan-2-yloxolan-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

143.13101 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 134.1
[M+Na]+ 166.12023 139.6
[M-H]- 142.12373 137.4
[M+NH4]+ 161.16483 155.6
[M+K]+ 182.09417 139.9
[M+H-H2O]+ 126.12827 128.9
[M+HCOO]- 188.12921 155.4
[M+CH3COO]- 202.14486 177.2
[M+Na-2H]- 164.10568 136.8
[M]+ 143.13046 131.4
[M]- 143.13156 131.4
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