CID 60136051

15836-83-6

Structural Information

Molecular Formula
C7H13NO
SMILES
CNCC1CCC=CO1
InChI
InChI=1S/C7H13NO/c1-8-6-7-4-2-3-5-9-7/h3,5,7-8H,2,4,6H2,1H3
InChIKey
XWQKLSSUNUCHIW-UHFFFAOYSA-N
Compound name
1-(3,4-dihydro-2H-pyran-2-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

127.09972 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 125.9
[M+Na]+ 150.088938 131.2
[M-H]- 126.092444 129.7
[M+NH4]+ 145.133543 146.3
[M+K]+ 166.062878 131.7
[M+H-H2O]+ 110.096980 120.2
[M+HCOO]- 172.097921 148.6
[M+CH3COO]- 186.113571 172.7
[M+Na-2H]- 148.074386 134.5
[M]+ 127.09917142 123.5
[M]- 127.10026858 123.5
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

patents stripe