CID 139026482

2361752-31-8

Structural Information

Molecular Formula
C7H15NO
SMILES
C[C@@H]1CC[C@H](OC1)CN
InChI
InChI=1S/C7H15NO/c1-6-2-3-7(4-8)9-5-6/h6-7H,2-5,8H2,1H3/t6-,7+/m1/s1
InChIKey
NRJPFXUAJVLEFG-RQJHMYQMSA-N
Compound name
[(2S,5R)-5-methyloxan-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

129.11537 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 128.4
[M+Na]+ 152.104588 133.6
[M-H]- 128.108094 131.6
[M+NH4]+ 147.149193 148.7
[M+K]+ 168.078528 133.9
[M+H-H2O]+ 112.112630 122.9
[M+HCOO]- 174.113571 148.9
[M+CH3COO]- 188.129221 173.5
[M+Na-2H]- 150.090036 134.1
[M]+ 129.11482142 123.9
[M]- 129.11591858 123.9
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.